4-(azepan-1-yl)-N-[(3S)-1-cyclohexylpiperidin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[(3S)-1-cyclohexylpiperidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[(3S)-1-cyclohexyl-3-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[(3S)-1-cyclohexyl-3-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[(3S)-1-cyclohexylpiperidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[(3S)-1-cyclohexyl-3-piperidyl]amine Formula: C21H35N5 MolecularWeight: 357.5361

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC=C2)NC3CCCN(C3)C4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC=C2)N[C@H]3CCCN(C3)C4CCCCC4

InChI

InChI=1S/C21H35N5/c1-2-7-15-25(14-6-1)20-12-13-22-21(24-20)23-18-9-8-16-26(17-18)19-10-4-3-5-11-19/h12-13,18-19H,1-11,14-17H2,(H,22,23,24)/t18-/m0/s1