(2R,4S)-4-tert-butyl-2-phenylsulfanyl-cyclohexan-1-one

Systemtic Name: (2R,4S)-4-tert-butyl-2-phenylsulfanyl-cyclohexan-1-one Openeye Name: (2R,4S)-4-tert-butyl-2-phenylsulfanyl-cyclohexanone CAS Name: (2R,4S)-4-tert-butyl-2-(phenylthio)-1-cyclohexanone IUPAC Name: (2R,4S)-4-tert-butyl-2-phenylsulfanylcyclohexan-1-one Traditional Name: (2R,4S)-4-tert-butyl-2-(phenylthio)cyclohexanone Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=O)C(C1)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)[C@H]1CCC(=O)[C@@H](C1)SC2=CC=CC=C2

InChI

InChI=1S/C16H22OS/c1-16(2,3)12-9-10-14(17)15(11-12)18-13-7-5-4-6-8-13/h4-8,12,15H,9-11H2,1-3H3/t12-,15+/m0/s1