(2R,3S)-3-butyl-2-(phenylsulfanylmethyl)cyclopentan-1-one

Systemtic Name: (2R,3S)-3-butyl-2-(phenylsulfanylmethyl)cyclopentan-1-one Openeye Name: (2R,3S)-3-butyl-2-(phenylsulfanylmethyl)cyclopentanone CAS Name: (2R,3S)-3-butyl-2-[(phenylthio)methyl]-1-cyclopentanone IUPAC Name: (2R,3S)-3-butyl-2-(phenylsulfanylmethyl)cyclopentan-1-one Traditional Name: (2R,3S)-3-butyl-2-[(phenylthio)methyl]cyclopentanone Formula: C16H22OS MolecularWeight: 262.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(=O)C1CSC2=CC=CC=C2

Isomeric SMILES

CCCC[C@H]1CCC(=O)[C@@H]1CSC2=CC=CC=C2

InChI

InChI=1S/C16H22OS/c1-2-3-7-13-10-11-16(17)15(13)12-18-14-8-5-4-6-9-14/h4-6,8-9,13,15H,2-3,7,10-12H2,1H3/t13-,15+/m0/s1