N-(3,5-dimethoxyphenyl)-2-[(3-oxidanylidene-2-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[(3-oxidanylidene-2-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[(3-oxo-2-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]acetamide CAS Name: N-(3,5-dimethoxyphenyl)-2-[(3-oxo-2-phenyl-1H-1,2,4-triazol-5-yl)thio]acetamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[(3-oxo-2-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]acetamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[(3-keto-2-phenyl-1H-1,2,4-triazol-5-yl)thio]acetamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NC(=O)N(N2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NC(=O)N(N2)C3=CC=CC=C3)OC

InChI

InChI=1S/C18H18N4O4S/c1-25-14-8-12(9-15(10-14)26-2)19-16(23)11-27-17-20-18(24)22(21-17)13-6-4-3-5-7-13/h3-10H,11H2,1-2H3,(H,19,23)(H,20,21,24)