4-(azepan-1-yl)-N-(3-cyanophenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(azepan-1-yl)-N-(3-cyanophenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-N-(3-cyanophenyl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-N-(3-cyanophenyl)-2-(3-pyridinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: 4-(azepan-1-yl)-N-(3-cyanophenyl)-2-pyridin-3-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-N-(3-cyanophenyl)-2-(3-pyridyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Formula: C26H27N7O MolecularWeight: 453.53888

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NC4=CC=CC(=C4)C#N)C5=CN=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NC4=CC=CC(=C4)C#N)C5=CN=CC=C5

InChI

InChI=1S/C26H27N7O/c27-16-19-7-5-9-21(15-19)29-26(34)33-14-10-23-22(18-33)25(32-12-3-1-2-4-13-32)31-24(30-23)20-8-6-11-28-17-20/h5-9,11,15,17H,1-4,10,12-14,18H2,(H,29,34)