[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylate CAS Name: (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylate Traditional Name: (3S,4S)-4,6-diphenyl-3,4-dihydro-2H-thiopyran-3-carboxylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C28H34O2S MolecularWeight: 434.63336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CSC(=CC2C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@H]2CSC(=C[C@H]2C3=CC=CC=C3)C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C28H34O2S/c1-19(2)23-15-14-20(3)16-26(23)30-28(29)25-18-31-27(22-12-8-5-9-13-22)17-24(25)21-10-6-4-7-11-21/h4-13,17,19-20,23-26H,14-16,18H2,1-3H3/t20-,23+,24+,25+,26-/m1/s1