4-(azepan-1-yl)-N-[1-cyclohexyl-2-(3-piperidin-1-ylpropyl)pyrrolidin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-cyclohexyl-2-(3-piperidin-1-ylpropyl)pyrrolidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-cyclohexyl-2-[3-(1-piperidyl)propyl]pyrrolidin-3-yl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-cyclohexyl-2-[3-(1-piperidinyl)propyl]-3-pyrrolidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-cyclohexyl-2-(3-piperidin-1-ylpropyl)pyrrolidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-cyclohexyl-2-(3-piperidinopropyl)pyrrolidin-3-yl]amine Formula: C28H48N6 MolecularWeight: 468.72092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(C3CCCN4CCCCC4)C5CCCCC5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCN(C3CCCN4CCCCC4)C5CCCCC5

InChI

InChI=1S/C28H48N6/c1-2-10-22-33(21-9-1)27-15-17-29-28(31-27)30-25-16-23-34(24-12-5-3-6-13-24)26(25)14-11-20-32-18-7-4-8-19-32/h15,17,24-26H,1-14,16,18-23H2,(H,29,30,31)