[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-phenylsulfanylethanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-phenylsulfanylethanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C24H30O2S MolecularWeight: 382.5588

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CSC2=CC=CC=C2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CSC2=CC=CC=C2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C24H30O2S/c1-18-14-15-21(24(2,3)19-10-6-4-7-11-19)22(16-18)26-23(25)17-27-20-12-8-5-9-13-20/h4-13,18,21-22H,14-17H2,1-3H3/t18-,21-,22-/m1/s1