4-(azepan-1-yl)-N-[1-(3,3-dimethylbutyl)piperidin-3-yl]pyrimidin-2-amine

Systemtic Name: 4-(azepan-1-yl)-N-[1-(3,3-dimethylbutyl)piperidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(3,3-dimethylbutyl)-3-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-(3,3-dimethylbutyl)-3-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(3,3-dimethylbutyl)piperidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-(3,3-dimethylbutyl)-3-piperidyl]amine Formula: C21H37N5 MolecularWeight: 359.55198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

Isomeric SMILES

CC(C)(C)CCN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

InChI

InChI=1S/C21H37N5/c1-21(2,3)11-16-25-13-8-9-18(17-25)23-20-22-12-10-19(24-20)26-14-6-4-5-7-15-26/h10,12,18H,4-9,11,13-17H2,1-3H3,(H,22,23,24)