(1S,2S)-2-(phenylmethylsulfanyl)cyclohexan-1-ol

Systemtic Name: (1S,2S)-2-(phenylmethylsulfanyl)cyclohexan-1-ol Openeye Name: (1S,2S)-2-benzylsulfanylcyclohexanol CAS Name: (1S,2S)-2-(phenylmethylthio)-1-cyclohexanol IUPAC Name: (1S,2S)-2-benzylsulfanylcyclohexan-1-ol Traditional Name: (1S,2S)-2-(benzylthio)cyclohexanol Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)SCC2=CC=CC=C2

Isomeric SMILES

C1CC[C@@H]([C@H](C1)O)SCC2=CC=CC=C2

InChI

InChI=1S/C13H18OS/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-3,6-7,12-14H,4-5,8-10H2/t12-,13-/m0/s1