2-(3,5-ditert-butylphenyl)sulfanylcyclohexan-1-one

Systemtic Name: 2-(3,5-ditert-butylphenyl)sulfanylcyclohexan-1-one Openeye Name: 2-(3,5-ditert-butylphenyl)sulfanylcyclohexanone CAS Name: 2-[(3,5-ditert-butylphenyl)thio]-1-cyclohexanone IUPAC Name: 2-(3,5-ditert-butylphenyl)sulfanylcyclohexan-1-one Traditional Name: 2-[(3,5-ditert-butylphenyl)thio]cyclohexanone Formula: C20H30OS MolecularWeight: 318.5166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)SC2CCCCC2=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)SC2CCCCC2=O)C(C)(C)C

InChI

InChI=1S/C20H30OS/c1-19(2,3)14-11-15(20(4,5)6)13-16(12-14)22-18-10-8-7-9-17(18)21/h11-13,18H,7-10H2,1-6H3