ethyl 1-[2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]quinazolin-4-yl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]quinazolin-4-yl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]quinazolin-4-yl]piperidine-3-carboxylate CAS Name: 1-[2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]-4-quinazolinyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]quinazolin-4-yl]piperidine-3-carboxylate Traditional Name: 1-[2-[4-(2-keto-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]quinazolin-4-yl]nipecotic acid ethyl ester Formula: C28H30N6O3 MolecularWeight: 498.5762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C2=NC(=NC3=CC=CC=C32)N4CCC(=CC4)N5C6=CC=CC=C6NC5=O

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C2=NC(=NC3=CC=CC=C32)N4CCC(=CC4)N5C6=CC=CC=C6NC5=O

InChI

InChI=1S/C28H30N6O3/c1-2-37-26(35)19-8-7-15-33(18-19)25-21-9-3-4-10-22(21)29-27(31-25)32-16-13-20(14-17-32)34-24-12-6-5-11-23(24)30-28(34)36/h3-6,9-13,19H,2,7-8,14-18H2,1H3,(H,30,36)