(2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-phenylsulfanyl-2H-furan-5-one

Systemtic Name: (2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-phenylsulfanyl-2H-furan-5-one Openeye Name: (2S)-2-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-3-phenylsulfanyl-2H-furan-5-one CAS Name: (2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-(phenylthio)-2H-furan-5-one IUPAC Name: (2S)-2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-phenylsulfanyl-2H-furan-5-one Traditional Name: (2S)-2-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-3-(phenylthio)-2H-furan-5-one Formula: C20H26O3S MolecularWeight: 346.48364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC2C(=CC(=O)O2)SC3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[C@@H]2C(=CC(=O)O2)SC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C20H26O3S/c1-13(2)16-10-9-14(3)11-17(16)22-20-18(12-19(21)23-20)24-15-7-5-4-6-8-15/h4-8,12-14,16-17,20H,9-11H2,1-3H3/t14-,16+,17-,20+/m1/s1