methyl 6-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]pyridine-3-carboxylate CAS Name: 6-[[4-(1H-benzimidazol-2-yl)anilino]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]pyridine-3-carboxylate Traditional Name: 6-[[4-(1H-benzimidazol-2-yl)phenyl]carbamoyl]nicotinic acid methyl ester Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H16N4O3/c1-28-21(27)14-8-11-18(22-12-14)20(26)23-15-9-6-13(7-10-15)19-24-16-4-2-3-5-17(16)25-19/h2-12H,1H3,(H,23,26)(H,24,25)