5-[1-(4-azanylcyclohexyl)piperidin-3-yl]-4-(azepan-4-yl)pyrimidin-2-amine

Systemtic Name: 5-[1-(4-azanylcyclohexyl)piperidin-3-yl]-4-(azepan-4-yl)pyrimidin-2-amine Openeye Name: 5-[1-(4-aminocyclohexyl)-3-piperidyl]-4-(azepan-4-yl)pyrimidin-2-amine CAS Name: 5-[1-(4-aminocyclohexyl)-3-piperidinyl]-4-(4-azepanyl)-2-pyrimidinamine IUPAC Name: 5-[1-(4-aminocyclohexyl)piperidin-3-yl]-4-(azepan-4-yl)pyrimidin-2-amine Traditional Name: [4-[3-[2-amino-4-(azepan-4-yl)pyrimidin-5-yl]piperidino]cyclohexyl]amine Formula: C21H36N6 MolecularWeight: 372.55074

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCNC1)C2=NC(=NC=C2C3CCCN(C3)C4CCC(CC4)N)N

Isomeric SMILES

C1CC(CCNC1)C2=NC(=NC=C2C3CCCN(C3)C4CCC(CC4)N)N

InChI

InChI=1S/C21H36N6/c22-17-5-7-18(8-6-17)27-12-2-4-16(14-27)19-13-25-21(23)26-20(19)15-3-1-10-24-11-9-15/h13,15-18,24H,1-12,14,22H2,(H2,23,25,26)