1-[(1R,2S)-2-phenethyl-1-phenylsulfanyl-cyclopropyl]pentan-1-one

Systemtic Name: 1-[(1R,2S)-2-phenethyl-1-phenylsulfanyl-cyclopropyl]pentan-1-one Openeye Name: 1-[(1R,2S)-2-phenethyl-1-phenylsulfanyl-cyclopropyl]pentan-1-one CAS Name: 1-[(1R,2S)-2-phenethyl-1-(phenylthio)cyclopropyl]-1-pentanone IUPAC Name: 1-[(1R,2S)-2-phenethyl-1-phenylsulfanylcyclopropyl]pentan-1-one Traditional Name: 1-[(1R,2S)-2-phenethyl-1-(phenylthio)cyclopropyl]pentan-1-one Formula: C22H26OS MolecularWeight: 338.50624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1(CC1CCC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)[C@]1(C[C@@H]1CCC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H26OS/c1-2-3-14-21(23)22(24-20-12-8-5-9-13-20)17-19(22)16-15-18-10-6-4-7-11-18/h4-13,19H,2-3,14-17H2,1H3/t19-,22+/m0/s1