4-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide

Systemtic Name: 4-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]benzamide Openeye Name: 4-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: 4-[[[5-oxo-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]thio]methyl]benzamide IUPAC Name: 4-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(4-benzyl-5-keto-1H-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C17H16N4O2S/c18-15(22)14-8-6-13(7-9-14)11-24-17-20-19-16(23)21(17)10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,18,22)(H,19,23)