4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-(2-pyrrolidinyl)-N-[2-[4-(1-pyrrolidinyl)phenyl]ethyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[2-(4-pyrrolidinophenyl)ethyl]-pyrrolidin-2-yl-amine Formula: C26H38N6 MolecularWeight: 434.62012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)N(CCC3=CC=C(C=C3)N4CCCC4)C5CCCN5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)N(CCC3=CC=C(C=C3)N4CCCC4)C5CCCN5

InChI

InChI=1S/C26H38N6/c1-2-4-20-31(19-3-1)25-13-16-28-26(29-25)32(24-8-7-15-27-24)21-14-22-9-11-23(12-10-22)30-17-5-6-18-30/h9-13,16,24,27H,1-8,14-15,17-21H2