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

Systemtic Name: 4-(azepan-1-yl)-N-[1-(3-methylsulfanylpropyl)piperidin-3-yl]pyrimidin-2-amine Openeye Name: 4-(azepan-1-yl)-N-[1-(3-methylsulfanylpropyl)-3-piperidyl]pyrimidin-2-amine CAS Name: 4-(1-azepanyl)-N-[1-[3-(methylthio)propyl]-3-piperidinyl]-2-pyrimidinamine IUPAC Name: 4-(azepan-1-yl)-N-[1-(3-methylsulfanylpropyl)piperidin-3-yl]pyrimidin-2-amine Traditional Name: [4-(azepan-1-yl)pyrimidin-2-yl]-[1-[3-(methylthio)propyl]-3-piperidyl]amine Formula: C19H33N5S MolecularWeight: 363.56382

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

Isomeric SMILES

CSCCCN1CCCC(C1)NC2=NC=CC(=N2)N3CCCCCC3

InChI

InChI=1S/C19H33N5S/c1-25-15-7-12-23-11-6-8-17(16-23)21-19-20-10-9-18(22-19)24-13-4-2-3-5-14-24/h9-10,17H,2-8,11-16H2,1H3,(H,20,21,22)