ethyl 3-[4-(azepan-1-yl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[4-(azepan-1-yl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-(azepan-1-yl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxo-propanoate CAS Name: 3-[4-(1-azepanyl)-2-(3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(azepan-1-yl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxopropanoate Traditional Name: 3-[4-(azepan-1-yl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-keto-propionic acid ethyl ester Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CN=CC=C3)N4CCCCCC4

Isomeric SMILES

CCOC(=O)CC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CN=CC=C3)N4CCCCCC4

InChI

InChI=1S/C23H29N5O3/c1-2-31-21(30)14-20(29)28-13-9-19-18(16-28)23(27-11-5-3-4-6-12-27)26-22(25-19)17-8-7-10-24-15-17/h7-8,10,15H,2-6,9,11-14,16H2,1H3