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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c1-24-15-9-7-13(8-10-15)11-17(23)19-12-16-20-21-18(25)22(16)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,19,23)(H,21,25)