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

Systemtic Name: ethyl 3-[4-(azepan-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-(azepan-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxo-propanoate CAS Name: 3-[4-(1-azepanyl)-2-phenyl-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-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-oxopropanoate Traditional Name: 3-[4-(azepan-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-3-keto-propionic acid ethyl ester Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N4O3/c1-2-31-22(30)16-21(29)28-15-12-20-19(17-28)24(27-13-8-3-4-9-14-27)26-23(25-20)18-10-6-5-7-11-18/h5-7,10-11H,2-4,8-9,12-17H2,1H3