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

Systemtic Name: 4-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenyl-benzamide Openeye Name: 4-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenyl-benzamide CAS Name: 4-[[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]methyl]-N-phenylbenzamide IUPAC Name: 4-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-N-phenylbenzamide Traditional Name: 4-[[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]methyl]-N-phenyl-benzamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-2-3-13-24-19(26)22-23-20(24)27-14-15-9-11-16(12-10-15)18(25)21-17-7-5-4-6-8-17/h4-12H,2-3,13-14H2,1H3,(H,21,25)(H,22,26)