(1-phenyl-1,2,3,4-tetrazol-5-yl) (1E)-N-[(4-methylphenyl)amino]-2-oxidanylidene-2-phenyl-ethanimidothioate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl) (1E)-N-[(4-methylphenyl)amino]-2-oxidanylidene-2-phenyl-ethanimidothioate Openeye Name: (1-phenyltetrazol-5-yl) (1E)-N-(4-methylanilino)-2-oxo-2-phenyl-ethanimidothioate CAS Name: (1E)-N-(4-methylanilino)-2-oxo-2-phenylethanimidothioic acid (1-phenyl-5-tetrazolyl) ester IUPAC Name: (1-phenyltetrazol-5-yl) (1E)-N-(4-methylanilino)-2-oxo-2-phenylethanimidothioate Traditional Name: (1E)-2-keto-2-phenyl-N-(p-toluidino)thioacetimidic acid (1-phenyltetrazol-5-yl) ester Formula: C22H18N6OS MolecularWeight: 414.48292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NN=C(C(=O)C2=CC=CC=C2)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N/N=C(\C(=O)C2=CC=CC=C2)/SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H18N6OS/c1-16-12-14-18(15-13-16)23-24-21(20(29)17-8-4-2-5-9-17)30-22-25-26-27-28(22)19-10-6-3-7-11-19/h2-15,23H,1H3/b24-21+