3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-methoxy-2-methyl-pyrido[3,4-d]pyrimidin-4-one

Systemtic Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-methoxy-2-methyl-pyrido[3,4-d]pyrimidin-4-one Openeye Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-methoxy-2-methyl-pyrido[3,4-d]pyrimidin-4-one CAS Name: 3-[4-[3-(1-azepanyl)propoxy]phenyl]-6-methoxy-2-methyl-4-pyrido[3,4-d]pyrimidinone IUPAC Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-methoxy-2-methylpyrido[3,4-d]pyrimidin-4-one Traditional Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-methoxy-2-methyl-pyrido[3,4-d]pyrimidin-4-one Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CN=C(C=C2C(=O)N1C3=CC=C(C=C3)OCCCN4CCCCCC4)OC

Isomeric SMILES

CC1=NC2=CN=C(C=C2C(=O)N1C3=CC=C(C=C3)OCCCN4CCCCCC4)OC

InChI

InChI=1S/C24H30N4O3/c1-18-26-22-17-25-23(30-2)16-21(22)24(29)28(18)19-8-10-20(11-9-19)31-15-7-14-27-12-5-3-4-6-13-27/h8-11,16-17H,3-7,12-15H2,1-2H3