(1S,2S)-1-methoxy-2-phenylsulfanyl-cyclohexane-1-carbonitrile

Systemtic Name: (1S,2S)-1-methoxy-2-phenylsulfanyl-cyclohexane-1-carbonitrile Openeye Name: (1S,2S)-1-methoxy-2-phenylsulfanyl-cyclohexanecarbonitrile CAS Name: (1S,2S)-1-methoxy-2-(phenylthio)-1-cyclohexanecarbonitrile IUPAC Name: (1S,2S)-1-methoxy-2-phenylsulfanylcyclohexane-1-carbonitrile Traditional Name: (1S,2S)-1-methoxy-2-(phenylthio)cyclohexanecarbonitrile Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCCCC1SC2=CC=CC=C2)C#N

Isomeric SMILES

CO[C@@]1(CCCC[C@@H]1SC2=CC=CC=C2)C#N

InChI

InChI=1S/C14H17NOS/c1-16-14(11-15)10-6-5-9-13(14)17-12-7-3-2-4-8-12/h2-4,7-8,13H,5-6,9-10H2,1H3/t13-,14-/m0/s1