N-(4-ethoxyphenyl)-2-[4-phenyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[4-phenyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: 2-(3-benzyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)-N-(4-ethoxyphenyl)acetamide CAS Name: N-(4-ethoxyphenyl)-2-[4-phenyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]acetamide IUPAC Name: 2-(3-benzyl-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-(3-benzyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)-N-p-phenetyl-acetamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2C(=S)N(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2C(=S)N(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2S/c1-2-31-22-15-13-20(14-16-22)26-24(30)18-28-25(32)29(21-11-7-4-8-12-21)23(27-28)17-19-9-5-3-6-10-19/h3-16H,2,17-18H2,1H3,(H,26,30)