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

Systemtic Name: [4-(azepan-1-yl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-cyclohexyl-methanone Openeye Name: [4-(azepan-1-yl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-cyclohexyl-methanone CAS Name: [4-(1-azepanyl)-2-(3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-cyclohexylmethanone IUPAC Name: [4-(azepan-1-yl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-cyclohexylmethanone Traditional Name: [4-(azepan-1-yl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-cyclohexyl-methanone Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)C4CCCCC4)C5=CN=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)C4CCCCC4)C5=CN=CC=C5

InChI

InChI=1S/C25H33N5O/c31-25(19-9-4-3-5-10-19)30-16-12-22-21(18-30)24(29-14-6-1-2-7-15-29)28-23(27-22)20-11-8-13-26-17-20/h8,11,13,17,19H,1-7,9-10,12,14-16,18H2