methyl 4-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbamoyl]benzoate Openeye Name: methyl 4-[[2-(4-pyridyl)-3H-benzimidazol-5-yl]carbamoyl]benzoate CAS Name: 4-[oxo-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbamoyl]benzoate Traditional Name: 4-[[2-(4-pyridyl)-3H-benzimidazol-5-yl]carbamoyl]benzoic acid methyl ester Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4

InChI

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