[(1S,2S)-3,4-dimethyl-2-methylsulfanyl-1-phenyl-cyclopent-3-en-1-yl]-phenyl-methanone

Systemtic Name: [(1S,2S)-3,4-dimethyl-2-methylsulfanyl-1-phenyl-cyclopent-3-en-1-yl]-phenyl-methanone Openeye Name: [(1S,2S)-3,4-dimethyl-2-methylsulfanyl-1-phenyl-cyclopent-3-en-1-yl]-phenyl-methanone CAS Name: [(1S,2S)-3,4-dimethyl-2-(methylthio)-1-phenyl-1-cyclopent-3-enyl]-phenylmethanone IUPAC Name: [(1S,2S)-3,4-dimethyl-2-methylsulfanyl-1-phenylcyclopent-3-en-1-yl]-phenylmethanone Traditional Name: [(1S,2S)-3,4-dimethyl-2-(methylthio)-1-phenyl-cyclopent-3-en-1-yl]-phenyl-methanone Formula: C21H22OS MolecularWeight: 322.46378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C1)(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)SC)C

Isomeric SMILES

CC1=C([C@@H]([C@@](C1)(C2=CC=CC=C2)C(=O)C3=CC=CC=C3)SC)C

InChI

InChI=1S/C21H22OS/c1-15-14-21(20(23-3)16(15)2,18-12-8-5-9-13-18)19(22)17-10-6-4-7-11-17/h4-13,20H,14H2,1-3H3/t20-,21-/m0/s1