[1-(diphenylamino)-1-oxidanylidene-propan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-(diphenylamino)-1-oxidanylidene-propan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(N-phenylanilino)ethyl] 2-(3-pyridyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(3-pyridinyl)-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(N-phenylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(N-phenylanilino)propan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(3-pyridyl)-3H-benzimidazole-5-carboxylic acid [2-keto-1-methyl-2-(N-phenylanilino)ethyl] ester Formula: C28H22N4O3 MolecularWeight: 462.49928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CN=CC=C5

Isomeric SMILES

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CN=CC=C5

InChI

InChI=1S/C28H22N4O3/c1-19(27(33)32(22-10-4-2-5-11-22)23-12-6-3-7-13-23)35-28(34)20-14-15-24-25(17-20)31-26(30-24)21-9-8-16-29-18-21/h2-19H,1H3,(H,30,31)