4-(azepan-1-yl)-N-[2-(2,3-dimethoxyphenyl)ethyl]-N-pyrrolidin-2-yl-pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[2-(2,3-dimethoxyphenyl)ethyl]-N-pyrrolidin-2-yl-pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[2-(2,3-dimethoxyphenyl)ethyl]-N-pyrrolidin-2-yl-pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[2-(2,3-dimethoxyphenyl)ethyl]-N-(2-pyrrolidinyl)-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[2-(2,3-dimethoxyphenyl)ethyl]-N-pyrrolidin-2-ylpyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[2-(2,3-dimethoxyphenyl)ethyl]-pyrrolidin-2-yl-amine Formula: C24H35N5O2 MolecularWeight: 425.567

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4

InChI

InChI=1S/C24H35N5O2/c1-30-20-10-7-9-19(23(20)31-2)13-18-29(21-11-8-14-25-21)24-26-15-12-22(27-24)28-16-5-3-4-6-17-28/h7,9-10,12,15,21,25H,3-6,8,11,13-14,16-18H2,1-2H3