1-(pyrimidin-2-ylsulfanylmethyl)cyclohexane-1,4-diol

Systemtic Name: 1-(pyrimidin-2-ylsulfanylmethyl)cyclohexane-1,4-diol Openeye Name: 1-(pyrimidin-2-ylsulfanylmethyl)cyclohexane-1,4-diol CAS Name: 1-[(2-pyrimidinylthio)methyl]cyclohexane-1,4-diol IUPAC Name: 1-(pyrimidin-2-ylsulfanylmethyl)cyclohexane-1,4-diol Traditional Name: 1-[(2-pyrimidylthio)methyl]cyclohexane-1,4-diol Formula: C11H16N2O2S MolecularWeight: 240.32194

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1O)(CSC2=NC=CC=N2)O

Isomeric SMILES

C1CC(CCC1O)(CSC2=NC=CC=N2)O

InChI

InChI=1S/C11H16N2O2S/c14-9-2-4-11(15,5-3-9)8-16-10-12-6-1-7-13-10/h1,6-7,9,14-15H,2-5,8H2