methyl 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N4O3/c1-12-17(21(27)28-3)13(2)22-18(12)20(26)25-10-8-14(9-11-25)19-23-15-6-4-5-7-16(15)24-19/h4-7,14,22H,8-11H2,1-3H3,(H,23,24)