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

Systemtic Name: 4-(azepan-1-yl)-2-phenyl-6-(pyridin-3-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Openeye Name: 4-(azepan-1-yl)-2-phenyl-6-(3-pyridylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine CAS Name: 4-(1-azepanyl)-2-phenyl-6-(3-pyridinylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-2-phenyl-6-(pyridin-3-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Traditional Name: 4-(azepan-1-yl)-2-phenyl-6-(3-pyridylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine Formula: C25H29N5 MolecularWeight: 399.53126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)CC4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)CC4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H29N5/c1-2-7-15-30(14-6-1)25-22-19-29(18-20-9-8-13-26-17-20)16-12-23(22)27-24(28-25)21-10-4-3-5-11-21/h3-5,8-11,13,17H,1-2,6-7,12,14-16,18-19H2