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

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl) (1E)-N-[(4-methoxyphenyl)amino]-2-oxidanylidene-propanimidothioate Openeye Name: (1-phenyltetrazol-5-yl) (1E)-N-(4-methoxyanilino)-2-oxo-propanimidothioate CAS Name: (1E)-N-(4-methoxyanilino)-2-oxopropanimidothioic acid (1-phenyl-5-tetrazolyl) ester IUPAC Name: (1-phenyltetrazol-5-yl) (1E)-N-(4-methoxyanilino)-2-oxopropanimidothioate Traditional Name: (1E)-2-keto-N-(p-anisidino)thiopropionimidic acid (1-phenyltetrazol-5-yl) ester Formula: C17H16N6O2S MolecularWeight: 368.41294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=CC=C(C=C1)OC)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC(=O)/C(=N\NC1=CC=C(C=C1)OC)/SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C17H16N6O2S/c1-12(24)16(19-18-13-8-10-15(25-2)11-9-13)26-17-20-21-22-23(17)14-6-4-3-5-7-14/h3-11,18H,1-2H3/b19-16+