4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(3,5,6-trimethylcyclohex-3-en-1-yl)ethyl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(3,5,6-trimethylcyclohex-3-en-1-yl)ethyl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(3,5,6-trimethylcyclohex-3-en-1-yl)ethyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-(2-pyrrolidinyl)-N-[2-(3,5,6-trimethyl-1-cyclohex-3-enyl)ethyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-pyrrolidin-2-yl-N-[2-(3,5,6-trimethylcyclohex-3-en-1-yl)ethyl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-pyrrolidin-2-yl-[2-(3,5,6-trimethylcyclohex-3-en-1-yl)ethyl]amine Formula: C25H41N5 MolecularWeight: 411.62654

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(CC(C1C)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4)C

Isomeric SMILES

CC1C=C(CC(C1C)CCN(C2CCCN2)C3=NC=CC(=N3)N4CCCCCC4)C

InChI

InChI=1S/C25H41N5/c1-19-17-20(2)21(3)22(18-19)11-16-30(23-9-8-12-26-23)25-27-13-10-24(28-25)29-14-6-4-5-7-15-29/h10,13,17,20-23,26H,4-9,11-12,14-16,18H2,1-3H3