(1R,2R,3R)-2-methyl-5-phenylsulfanyl-3-(phenylsulfonyl)cyclohept-4-en-1-ol

Systemtic Name: (1R,2R,3R)-2-methyl-5-phenylsulfanyl-3-(phenylsulfonyl)cyclohept-4-en-1-ol Openeye Name: (1R,2R,3R)-3-(benzenesulfonyl)-2-methyl-5-phenylsulfanyl-cyclohept-4-en-1-ol CAS Name: (1R,2R,3R)-3-(benzenesulfonyl)-2-methyl-5-(phenylthio)-1-cyclohept-4-enol IUPAC Name: (1R,2R,3R)-3-(benzenesulfonyl)-2-methyl-5-phenylsulfanylcyclohept-4-en-1-ol Traditional Name: (1R,2R,3R)-3-besyl-2-methyl-5-(phenylthio)cyclohept-4-en-1-ol Formula: C20H22O3S2 MolecularWeight: 374.51688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCC(=CC1S(=O)(=O)C2=CC=CC=C2)SC3=CC=CC=C3)O

Isomeric SMILES

C[C@@H]1[C@@H](CCC(=C[C@@H]1S(=O)(=O)C2=CC=CC=C2)SC3=CC=CC=C3)O

InChI

InChI=1S/C20H22O3S2/c1-15-19(21)13-12-17(24-16-8-4-2-5-9-16)14-20(15)25(22,23)18-10-6-3-7-11-18/h2-11,14-15,19-21H,12-13H2,1H3/t15-,19-,20+/m1/s1