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

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(4-methyl-2-oxidanyl-phenyl)ethanamide Openeye Name: N-(2-hydroxy-4-methyl-phenyl)-2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(2-hydroxy-4-methylphenyl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(2-hydroxy-4-methylphenyl)-2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(2-hydroxy-4-methyl-phenyl)-2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O3S/c1-11-3-8-14(15(23)9-11)19-16(24)10-22-17(20-21-18(22)26)12-4-6-13(25-2)7-5-12/h3-9,23H,10H2,1-2H3,(H,19,24)(H,21,26)