3-(2-ethoxyphenyl)-2-[(4-methyl-1,4-diazepan-1-yl)methyl]pyrido[3,4-d]pyrimidin-4-one

Systemtic Name: 3-(2-ethoxyphenyl)-2-[(4-methyl-1,4-diazepan-1-yl)methyl]pyrido[3,4-d]pyrimidin-4-one Openeye Name: 3-(2-ethoxyphenyl)-2-[(4-methyl-1,4-diazepan-1-yl)methyl]pyrido[3,4-d]pyrimidin-4-one CAS Name: 3-(2-ethoxyphenyl)-2-[(4-methyl-1,4-diazepan-1-yl)methyl]-4-pyrido[3,4-d]pyrimidinone IUPAC Name: 3-(2-ethoxyphenyl)-2-[(4-methyl-1,4-diazepan-1-yl)methyl]pyrido[3,4-d]pyrimidin-4-one Traditional Name: 2-[(4-methyl-1,4-diazepan-1-yl)methyl]-3-o-phenetyl-pyrido[3,4-d]pyrimidin-4-one Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NC3=C(C2=O)C=CN=C3)CN4CCCN(CC4)C

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NC3=C(C2=O)C=CN=C3)CN4CCCN(CC4)C

InChI

InChI=1S/C22H27N5O2/c1-3-29-20-8-5-4-7-19(20)27-21(16-26-12-6-11-25(2)13-14-26)24-18-15-23-10-9-17(18)22(27)28/h4-5,7-10,15H,3,6,11-14,16H2,1-2H3