(1S,2S)-2-[4-(2-methylsulfanylpyrimidin-4-yl)piperazin-1-yl]cyclohexan-1-ol

Systemtic Name: (1S,2S)-2-[4-(2-methylsulfanylpyrimidin-4-yl)piperazin-1-yl]cyclohexan-1-ol Openeye Name: (1S,2S)-2-[4-(2-methylsulfanylpyrimidin-4-yl)piperazin-1-yl]cyclohexanol CAS Name: (1S,2S)-2-[4-[2-(methylthio)-4-pyrimidinyl]-1-piperazinyl]-1-cyclohexanol IUPAC Name: (1S,2S)-2-[4-(2-methylsulfanylpyrimidin-4-yl)piperazin-1-yl]cyclohexan-1-ol Traditional Name: (1S,2S)-2-[4-[2-(methylthio)pyrimidin-4-yl]piperazino]cyclohexanol Formula: C15H24N4OS MolecularWeight: 308.44226

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)N2CCN(CC2)C3CCCCC3O

Isomeric SMILES

CSC1=NC=CC(=N1)N2CCN(CC2)[C@H]3CCCC[C@@H]3O

InChI

InChI=1S/C15H24N4OS/c1-21-15-16-7-6-14(17-15)19-10-8-18(9-11-19)12-4-2-3-5-13(12)20/h6-7,12-13,20H,2-5,8-11H2,1H3/t12-,13-/m0/s1