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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NNC2=S)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NNC2=S)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C18H18N4O2S/c23-17(13-24-15-9-5-2-6-10-15)19-11-16-20-21-18(25)22(16)12-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,19,23)(H,21,25)