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

Systemtic Name: 4-(azepan-1-yl)-N-[2-(4-dimethylaminophenyl)ethyl]-N-pyrrolidin-2-yl-pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[2-(4-dimethylaminophenyl)ethyl]-N-pyrrolidin-2-yl-pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[2-(4-dimethylaminophenyl)ethyl]-N-(2-pyrrolidinyl)-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[2-(4-dimethylaminophenyl)ethyl]-N-pyrrolidin-2-ylpyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[2-(4-dimethylaminophenyl)ethyl]-pyrrolidin-2-yl-amine Formula: C24H36N6 MolecularWeight: 408.58284

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4

InChI

InChI=1S/C24H36N6/c1-28(2)21-11-9-20(10-12-21)14-19-30(22-8-7-15-25-22)24-26-16-13-23(27-24)29-17-5-3-4-6-18-29/h9-13,16,22,25H,3-8,14-15,17-19H2,1-2H3