propyl 3-[5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate

Systemtic Name: propyl 3-[5-azanyl-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate Openeye Name: propyl 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate CAS Name: 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid propyl ester IUPAC Name: propyl 3-[5-amino-4-(6-methyl-1H-benzimidazol-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate Traditional Name: 3-[2-amino-4-keto-3-(6-methyl-1H-benzimidazol-2-yl)-2-pyrrolin-1-yl]benzoic acid propyl ester Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)N2CC(=O)C(=C2N)C3=NC4=C(N3)C=C(C=C4)C

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)N2CC(=O)C(=C2N)C3=NC4=C(N3)C=C(C=C4)C

InChI

InChI=1S/C22H22N4O3/c1-3-9-29-22(28)14-5-4-6-15(11-14)26-12-18(27)19(20(26)23)21-24-16-8-7-13(2)10-17(16)25-21/h4-8,10-11H,3,9,12,23H2,1-2H3,(H,24,25)