ethyl 1-[6-(3-cyanophenyl)carbonyl-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-(3-cyanophenyl)carbonyl-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-(3-cyanobenzoyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[(3-cyanophenyl)-oxomethyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(3-cyanobenzoyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(3-cyanobenzoyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)C4=CC=CC(=C4)C#N)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)C4=CC=CC(=C4)C#N)C

InChI

InChI=1S/C24H27N5O3/c1-3-32-24(31)18-7-10-28(11-8-18)22-20-15-29(12-9-21(20)26-16(2)27-22)23(30)19-6-4-5-17(13-19)14-25/h4-6,13,18H,3,7-12,15H2,1-2H3