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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2=NNC(=S)N2CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2=NNC(=S)N2CC3=CC=CC=C3

InChI

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