basic_info |
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Product_Name: | 2-([(4-METHYL-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]METHYL)BENZONITRILE |
EnglishSynonyms: | 2-([(4-METHYL-5-OXO-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-3-YL)SULFANYL]METHYL)BENZONITRILE |
pro_mdlNumber: | MFCD17433172 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | Cn1c(=O)[nH]nc1SCc2ccccc2C#N |
InChi: | InChI=1S/C11H10N4OS/c1-15-10(16)13-14-11(15)17-7-9-5-3-2-4-8(9)6-12/h2-5H,7H2,1H3,(H,13,16) |
InChiKey: | InChIKey=KDYUKTJOYYGLRW-UHFFFAOYSA-N |
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