4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-(2-pyrrolidinyl)-N-[2-(2,4,6-trimethoxyphenyl)ethyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(2,4,6-trimethoxyphenyl)ethyl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-pyrrolidin-2-yl-[2-(2,4,6-trimethoxyphenyl)ethyl]amine Formula: C25H37N5O3 MolecularWeight: 455.59298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4)OC

InChI

InChI=1S/C25H37N5O3/c1-31-19-17-21(32-2)20(22(18-19)33-3)11-16-30(23-9-8-12-26-23)25-27-13-10-24(28-25)29-14-6-4-5-7-15-29/h10,13,17-18,23,26H,4-9,11-12,14-16H2,1-3H3