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

Systemtic Name: ethyl 1-[6-(cyclohexylcarbamoyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-(cyclohexylcarbamoyl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-[(cyclohexylamino)-oxomethyl]-2-(3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(cyclohexylcarbamoyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(cyclohexylcarbamoyl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C27H36N6O3 MolecularWeight: 492.61314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NC4CCCCC4)C5=CN=CC=C5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NC4CCCCC4)C5=CN=CC=C5

InChI

InChI=1S/C27H36N6O3/c1-2-36-26(34)19-10-14-32(15-11-19)25-22-18-33(27(35)29-21-8-4-3-5-9-21)16-12-23(22)30-24(31-25)20-7-6-13-28-17-20/h6-7,13,17,19,21H,2-5,8-12,14-16,18H2,1H3,(H,29,35)