diff --git "a/data/36.csv" "b/data/36.csv" --- "a/data/36.csv" +++ "b/data/36.csv" @@ -1,64782 +1,65746 @@ product_name,product_smiles,heavy_atoms,r1_hashisy -"""234A39D87BBB3516_B33C5A4F853A7920_6003_DP""","""CC(CCOC1=CC=C(C=C1[N](=O)=O)F)C2CCNCC2""",21,"""CB23BC62DB01613B""" -"""C58C5CB90478DC13_EF4C272765F8768C_6003_DP""","""CC(CCOC1=CC=C(C=C1C(N)=O)F)C2CCNCC2""",21,"""CB23BC62DB01613B""" -"""A13A423887FC2F70_795AE7C64DF0B605_6003_DP""","""CC(CCOC1=CC=CC=C1C(F)(F)F)C2CCNCC2""",21,"""CB23BC62DB01613B""" -"""C602BB346D359C4E_B66508065450A944_6003_DP""","""CC(CCOC1=CC=C(C=C1[N](=O)=O)Cl)C2CCNCC2""",21,"""CB23BC62DB01613B""" -"""E28B3E8BAEB22822_35DCA57F85B3C3C1_6003_DP""","""CC(CCOC1=CC(=C(C(=C1)C)C#N)C)C2CCNCC2""",21,"""CB23BC62DB01613B""" -"""C42725CDF39F239A_33F142E2276349B2_6003_DP""","""CC(CCOC1=CC=C2C(=C1)OCC2=O)C3CCNCC3""",21,"""CB23BC62DB01613B""" -"""A141690141369313_7E64BC425499B2D5_6003_DP""","""CC(CCOC1=CC=C([S](C)(=O)=O)C=C1)C2CCNCC2""",21,"""CB23BC62DB01613B""" 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-"""1AAD81896D309182_679962494F95E3CA_6003_DP""","""N2CCCC(CCOC1=CC(=CC=C1C#N)C(F)(F)F)C2""",21,"""E5BC5FC487E95CA0""" -"""FDE59931D7F0CFDE_6AB16EAFA04A0B22_6003_DP""","""N2CCCC(CCOC1=CC=C(C(OCC)=O)C=C1Cl)C2""",21,"""E5BC5FC487E95CA0""" -"""602F1EC66FE74522_1F7533454C831E10_6003_DP""","""N2CCCC(CCOC1=CC=C(C(=C1)OC(F)F)C#N)C2""",21,"""E5BC5FC487E95CA0""" -"""6DB7E83344B19792_EC1690C52B88F086_6003_DP""","""N2CCCC(CCOC1=C(C=CC=C1C(O)=O)[N](=O)=O)C2""",21,"""E5BC5FC487E95CA0""" -"""9F97FF8903410CCC_66123F87738BFC52_6003_DP""","""N2CCCC(CCOC1=CC=C(C(C(C)(C)C)=O)C=C1)C2""",21,"""E5BC5FC487E95CA0""" -"""133CC8AB8A8CB9D8_07D9184FB29CF5E7_6003_DP""","""N2CCCC(CCOC1=CC=C(C(CCCCl)=O)C=C1)C2""",21,"""E5BC5FC487E95CA0""" -"""8E23A9082B0010D0_4D1F2C5D36BF21B9_6003_DP""","""N2CCCC(CCOC1=CC=C(C(OC)=O)C(=C1)OC)C2""",21,"""E5BC5FC487E95CA0""" -"""069D658B05892289_A52D3F08C24811E3_6003_DP""","""N2CCCC(CCOC1=C(C=C(C(OC)=O)C(=C1)F)Cl)C2""",21,"""E5BC5FC487E95CA0""" -"""9DD75FB259904C96_D14F95B557B9A176_6003_DP""","""N3CCCC(CCOC1=CC=C(C(=C1)Cl)C(=O)C2CC2)C3""",21,"""E5BC5FC487E95CA0""" -"""3C5E8B0725DE0AFF_B376CD68AB12B4A7_6003_DP""","""N2CCCC(CCOC1=CC=C(C(OC)=O)C(=C1Cl)F)C2""",21,"""E5BC5FC487E95CA0""" -"""C0ADF5662D0A093E_390E47BA4B8B6A80_6003_DP""","""N2CCCC(CCOC1=C(C=C(C(OC)=O)C=C1F)F)C2""",21,"""E5BC5FC487E95CA0""" -"""D5B7BA1A9125000E_46BCA1AC86B2DD3C_6003_DP""","""N3CCCC(CCOC1=CC=C2C(=C1)NC(OC2=O)=O)C3""",21,"""E5BC5FC487E95CA0""" -"""EF2D29FC7F3BAC6A_CF7B38477E829C7E_6003_DP""","""N2CCCC(CCOC1=CC(=C(C=C1C(OC)=O)Cl)F)C2""",21,"""E5BC5FC487E95CA0""" -"""5BFFBD9C49F62905_8B5C4F33B60AB43F_6003_DP""","""N2CCCC(CCOC1=CC(=CC=C1C#N)[S](Cl)(=O)=O)C2""",21,"""E5BC5FC487E95CA0""" -"""3DFC2295F6CD92E3_C1190A73396028EB_6003_DP""","""N2CCCC(CCOC1=CC(=CC=C1C#N)[S](N)(=O)=O)C2""",21,"""E5BC5FC487E95CA0""" -"""15371B98B5A6BAC9_C66651CDFB3A31E5_6003_DP""","""N3CCCC(CCOC1=CC=C2C(=C1)CCCCC2=O)C3""",21,"""E5BC5FC487E95CA0""" -"""4E91BE01FB9C9643_CF7BB1BFCDD2B4F2_6003_DP""","""N2CCCC(CCOC1=C(C=C(C(OC)=O)C(=C1)Cl)F)C2""",21,"""E5BC5FC487E95CA0""" -"""650DFCAFFE007808_7BCA39E81E898F2A_6003_DP""","""N2CCCC(CCOC1=C(C(=CC=C1)[S](Cl)(=O)=O)C#N)C2""",21,"""E5BC5FC487E95CA0""" -"""E3157216D251FEAC_39E7B13DF1D8797F_6003_DP""","""N2CCCC(CCOC1=CC=C(C(=C1)[S](Cl)(=O)=O)C#N)C2""",21,"""E5BC5FC487E95CA0""" -"""D2212FB65B7B7CD4_607A54D0377FE1A5_6003_DP""","""N2CCCC(CCOC1=CC(=C(C(=C1)F)C(F)(F)F)F)C2""",21,"""E5BC5FC487E95CA0""" -"""6FD35CFBE6C31B65_E007ED789F2F366A_6003_DP""","""N2CCCC(CCOC1=C(C=C(C(OC)=O)C=C1Cl)C)C2""",21,"""E5BC5FC487E95CA0""" -"""BF08349C003EC189_2AA50A0F05F81557_6003_DP""","""N2CCCC(CCOC1=CC=C(C(N(C)C)=O)C=C1F)C2""",21,"""E5BC5FC487E95CA0""" -"""4943F0E981097A89_5E11B5F272D21139_6003_DP""","""N2CCCC(CCOC1=C(C=C(C=C1C(OC)=O)F)Cl)C2""",21,"""E5BC5FC487E95CA0""" -"""397206C0C67E3E6B_23194D292278FA81_6003_DP""","""N2CCCC(CCOC1=CC(=CC=C1C(OCC)=O)F)C2""",21,"""E5BC5FC487E95CA0""" 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-"""ECBE0AAC7EC025F6_34BA25F968C258C5_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=CC=C(C(=C2C)F)C#N""",21,"""768370D4FB49CE28""" -"""2AB133A64A1CA211_B5A93D68E4347930_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=CC(=CC=C2C#N)OC""",21,"""768370D4FB49CE28""" -"""1B8941F2B0980524_8F58EF6EB436D4F0_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=CC=CC(=C2C#N)C#N""",21,"""768370D4FB49CE28""" -"""C5B307A201A4A212_00CB5D6908D3C89C_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=CC=C(C(CC)=O)C=C2""",21,"""768370D4FB49CE28""" -"""1B615D7FE4D31719_12423EBE13949EF5_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=C(C(=CC=C2C#N)C)C""",21,"""768370D4FB49CE28""" -"""B455577170D1C8FA_530C28CB3D3822D6_6003_UN""","""O([C@H](C(F)F)C1=CC=CC=C1)C2=CC=CC=C2C(CC)=O""",21,"""768370D4FB49CE28""" -"""3991F93E7A9CFE67_C01B56BFD746ECDE_6003_DP""","""N2CCCC(OC1=CC=C(OC)C=C1C(=O)N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""BF1C3C22347F4E5F_5E393131A91624B0_6003_DP""","""N2CCCC(OC1=CC=C(C(OC)=O)C(=C1)C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""CDE775F5D529B870_8134B82DAFA5C129_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)OC)C(=O)N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""486A0D55AC8AD57C_5CF4FEC9FEB8C5FC_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)N=CNC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""E73E4007F02CC530_2F4413C4EC3CA2FD_6003_DP""","""N3CCCC(OC1=CC=C(C=C1)C(=O)C2CC2)(CC3)C#C""",21,"""FC49241E11C98052""" -"""568419DBE9E6142D_9745BC7D4D3BA667_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)[N](=O)=O)C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""9BA656E772DE5663_DDBB09E7A6B29889_6003_DP""","""N2CCCC(OC1=CC=C(C(OC)=O)C(=C1)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""01A3AE83E746195D_A30D7CDEB1F1A85A_6003_DP""","""N2CCCC(OC1=CC=C(C(OC)=O)C(=C1)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""2474E729047E14B1_465B2C422745FEAD_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)F)C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""4ADEFD6E25BFD19B_EEBBB2E7563F2184_6003_DP""","""N2CCCC(OC1=CC=C(C(C(C)Cl)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""4179D28AB1C80F1F_AA9C99EEB81A5009_6003_DP""","""N2CCCC(OC1=CC(=CC=C1C(=O)C)OC)(CC2)C#C""",21,"""FC49241E11C98052""" -"""A10D554E479036F4_482A80015749E45E_6003_DP""","""N2CCCC(OC1=CC(=C(C(=C1)OC)C#N)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""3CE1F04061279D64_D9037242BB9A44C1_6003_DP""","""N3CCCC(OC1=CC=C(F)C2=C1C(CC2)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""71D3023B0DB4BD55_4D905DC478AB0E51_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)C(OC2=O)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""C754E8C3B3703AF0_101A42FC7B8A25C8_6003_DP""","""N2CCCC(OC1=C(C=CC=C1OC)[N](=O)=O)(CC2)C#C""",21,"""FC49241E11C98052""" -"""761E284F084B566C_B1AE2F1F670C1E6B_6003_DP""","""N2CCCC(OC1=CC=C(C(OC)=O)C=C1F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""241968EEC705E280_A4A0D3B3A3D02B87_6003_DP""","""N2CCCC(OC1=CC=C(C(C(Br)Br)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""64FECB6CF5C0AE8B_BFF255D18DB267C3_6003_DP""","""N2CCCC(OC1=CC=C(C=C1C)C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""B4CF3A85D04DB5D4_B655999121EF5B2A_6003_DP""","""N2CCCC(OC1=C(C=C(C=C1[N](=O)=O)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""182724E6FFB84F99_90FEBC180EDA98A2_6003_DP""","""N2CCCC(OC1=CC=C(C(CC)=O)C(=C1)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""4BB443415E538558_548D54515B97D80B_6003_DP""","""N2CCCC(OC1=CC=C(C(N(C)C)=N)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""A29C360182CC514E_6695D290B7A024A3_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)OC)C(=O)C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""18358E6E3E341000_DF9100EC525CB1F2_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)C(NC2=O)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""5F57CBA666BDE6AD_09CF28E2352E1FFE_6003_DP""","""N2CCCC(OC1=C(C(=CC=C1C)F)[N](=O)=O)(CC2)C#C""",21,"""FC49241E11C98052""" -"""5EC2BC598B92B7C3_982FB409AB44022F_6003_DP""","""N3CCCC(OC1=CC2=C(C(=C1)C)C(CC2)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""23E80733D498C495_26429522BFD711CF_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)CCCC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""10011A9682795041_6BEA45AAA524C76F_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)F)C(=O)C#C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""21838EE144C246B5_D908C635C28E159E_6003_DP""","""N2CCCC(OC1=CC=C([N](=O)=O)C=C1C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""BA5CD989733A4908_4ED111561E33CD81_6003_DP""","""N2CCCC(OC1=CC=CC(=C1C(F)(F)F)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""20C2A514CECA8390_B366854D0C341F59_6003_DP""","""N2CCCC(OC1=CC(=CC=C1[N](=O)=O)OC)(CC2)C#C""",21,"""FC49241E11C98052""" -"""EDA1E2DC92FDF4A1_3514FBD01CE08E7A_6003_DP""","""N2CCCC(OC1=CC=CC(=C1C(OC)=O)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""188E42E3657FE3D9_DC9C6940DE54B2AC_6003_DP""","""N2CCCC(OC1=C(C=CC=C1C(O)=O)C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""F7B2ED30A663F692_7327CF965F24019D_6003_DP""","""N3CCCC(OC1=CC=CC2=C1C(NC=N2)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""C0B08B06057D4CBD_8D4B83C74F9549E2_6003_DP""","""N2CCCC(OC1=CC=C(C(NC)=O)C(=C1)C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""69B3E7E82BD9ADBE_2511C06B6049D5FB_6003_DP""","""N2CCCC(OC1=CC=C([S](CC)(=O)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""15941BC0EB0669C4_BDD56ADAFEFE3820_6003_DP""","""N2CCCC(OC1=CC=C(OC)C=C1[N](=O)=O)(CC2)C#C""",21,"""FC49241E11C98052""" -"""7A5C54EC07E0937D_157353AF8D922CF6_6003_DP""","""N2CCCC(OC1=CC=C(C(C)N=C=S)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""735B6DEE340E55AE_AEFACDCE62C8C8ED_6003_DP""","""N2CCCC(OC1=CC=C(F)C=C1C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""B1E775329E97C405_8EB3EE94E529428B_6003_DP""","""N2CCCC(OC1=C(C=CC=C1[N](=O)=O)C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""813EEA4C3AD5E6A4_94CDC03A376EC528_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)C(CC2=O)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""BD7DC86B93394E40_5F14B9903483AD53_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1)C)C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""C85C1E6DC88A96D9_A4D571725016FDDF_6003_DP""","""N2CCCC(OC1=CC=C(C=C1[N](=O)=O)C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""60D9DD5583024922_0ABE7C3A8904DC5B_6003_DP""","""N2CCCC(OC1=C(C(=CC=C1)F)C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""B30E8EA642A28594_B89F43626375597D_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)CC[S]2(=O)=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""CCB2AA590E367AD8_6B7259F3D4396174_6003_DP""","""N2CCCC(OC1=C(C=C(C(C)=O)C(=C1)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""5C140F96063EC312_C133AEB60609D5B7_6003_DP""","""N2CCCC(OC1=CC=C([S](CCl)(=O)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""14881FC9D77ACB91_6C255C713634F2DD_6003_DP""","""N2CCCC(OC1=CC=C(C=C1)C(=O)N=C=S)(CC2)C#C""",21,"""FC49241E11C98052""" -"""C9B3C000BDEF5619_035D4E70D1B24853_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)CCOC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""45758AA5667D70B7_FD6890EDF47243CA_6003_DP""","""N2CCCC(OC1=CC=CC=C1C(=O)CC#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""7F6DA8F1C7D025F6_9BC8A03D73F95278_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1C(C)=O)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""2D065234070F25FC_1261D469E13ACD3B_6003_DP""","""N2CCCC(OC1=CC=C(C(F)(F)F)C(=C1)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""A6BBF02272C28BB2_E78608FC705F7B7B_6003_DP""","""N2CCCC(OC1=C(C=C([N](=O)=O)C(=C1)F)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""AFD7EF5BBE6E64AB_76462DB9B8C70B13_6003_DP""","""N2CCCC(OC1=CC=C(C=C1F)C(F)(F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""DBBC66083294B300_17FE9FC42B76CF78_6003_DP""","""N2CCCC(OC1=C(C=C([N](=O)=O)C(=C1)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""1BF892A78507B6FD_53B982D16C12ABD7_6003_DP""","""N2CCCC(OC1=CC(=C(C=C1[N](=O)=O)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""B6365E0E80553BD0_DA92A755040C970A_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)OCCC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""C482C1F6ED3BBC85_FABE5EA3B8071C16_6003_DP""","""N2CCCC(OC1=CC(=CC=C1C(F)(F)F)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""929113EC1504D6B9_E78CD137D730EA57_6003_DP""","""N2CCCC(OC1=CC=CC(=C1C(NC)=O)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""53F9D44FC76DA7DA_440A1E05F7A29D5E_6003_DP""","""N2CCCC(OC1=CC=C(C(OCC)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""B3181704B26D16ED_4F9FB61DBBFB587D_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1)CCNC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""4413C8E4E508C6E9_2D54F36254CC8F59_6003_DP""","""N2CCCC(OC1=CC=C(C(C(C)C)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""A37430B7EED759B4_17395B6ADC8B11E7_6003_DP""","""N2CCCC(OC1=CC=C(C(C(F)Br)=O)C=C1)(CC2)C#C""",21,"""FC49241E11C98052""" -"""2311DA77E2F750A3_DF3A71F787C01556_6003_DP""","""N3CCCC(OC2=CC1=C(C(CO1)=O)C=C2F)(CC3)C#C""",21,"""FC49241E11C98052""" -"""311A02B8F10CA52D_D18735DF8A38633E_6003_DP""","""N2CCCC(OC1=CC=C(C=C1)C(=O)CC#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""D2F5C834493B9136_09C899E45941A7BE_6003_DP""","""N2CCCC(OC1=CC=C(C(CC)=O)C(=C1)C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""2463A3CC207AB318_EDCB8045B03A87D3_6003_DP""","""N2CCCC(OC1=CC=C(C(CCl)=O)C=C1Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""F78183CF45389BD1_A1A857230F5F17CF_6003_DP""","""N2CCCC(OC1=C(C=CC=C1C(OC)=O)F)(CC2)C#C""",21,"""FC49241E11C98052""" -"""8B705F64F0E598EB_5B6B0DE445B428D1_6003_DP""","""N3CCCC(OC1=CC=C2C(=C1F)CCC2=O)(CC3)C#C""",21,"""FC49241E11C98052""" -"""7101A29681122AD2_2EBE0098ADE553B3_6003_DP""","""N2CCCC(OC1=CC=C(C(=C1[N](=O)=O)F)Cl)(CC2)C#C""",21,"""FC49241E11C98052""" -"""AFE6BE928AE0300F_FC91F78877A1555A_6003_DP""","""N2CCCC(OC1=CC=C(C=C1C(OC)=O)C)(CC2)C#C""",21,"""FC49241E11C98052""" -"""51BB9955ACF34407_ED34F3C55A7E5419_6003_DP""","""N3CCCC(OC1=CC2=C(C=C1C#N)[NH]C=N2)(CC3)C#C""",21,"""FC49241E11C98052""" -"""58ECCD69921E957D_76B19CAED90E636E_6003_DP""","""N2CCCC(OC1=CC=C([S](C)=O)C(=C1)C#N)(CC2)C#C""",21,"""FC49241E11C98052""" -"""C5439245A27B3ED9_F361A000C07C7A2E_6003_DP""","""N3CCCC(OC1=CC=CC2=C1C(CC2=O)=O)(CC3)C#C""",21,"""FC49241E11C98052""" 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