N-(4-methyl-2-oxidanyl-phenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: N-(4-methyl-2-oxidanyl-phenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(2-hydroxy-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(2-hydroxy-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(2-hydroxy-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(2-hydroxy-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)O

InChI

InChI=1S/C18H18N4O2S/c1-11-4-3-5-13(8-11)17-20-21-18(25)22(17)10-16(24)19-14-7-6-12(2)9-15(14)23/h3-9,23H,10H2,1-2H3,(H,19,24)(H,21,25)