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

Systemtic Name: [1-oxidanylidene-1-(pyridin-2-ylamino)propan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-pyridylamino)ethyl] 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(2-pyridinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyridin-2-ylamino)propan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [2-keto-1-methyl-2-(2-pyridylamino)ethyl] ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=N1)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=N1)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3/c1-14(21(27)26-19-9-5-6-12-23-19)29-22(28)16-10-11-17-18(13-16)25-20(24-17)15-7-3-2-4-8-15/h2-14H,1H3,(H,24,25)(H,23,26,27)