N-(4-methylphenyl)-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(4-methylphenyl)-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]benzamide Openeye Name: 4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-N-(p-tolyl)benzamide CAS Name: N-(4-methylphenyl)-4-[[(1-phenyl-5-tetrazolyl)thio]methyl]benzamide IUPAC Name: N-(4-methylphenyl)-4-[(1-phenyltetrazol-5-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(1-phenyltetrazol-5-yl)thio]methyl]-N-(p-tolyl)benzamide Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H19N5OS/c1-16-7-13-19(14-8-16)23-21(28)18-11-9-17(10-12-18)15-29-22-24-25-26-27(22)20-5-3-2-4-6-20/h2-14H,15H2,1H3,(H,23,28)