(1S)-1-bis[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy]phosphorylbut-3-ene-1-thiol

Systemtic Name: (1S)-1-bis[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy]phosphorylbut-3-ene-1-thiol Openeye Name: (1S)-1-bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]phosphorylbut-3-ene-1-thiol CAS Name: (1S)-1-bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]phosphoryl-3-butene-1-thiol IUPAC Name: (1S)-1-bis[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy]phosphorylbut-3-ene-1-thiol Traditional Name: (1S)-1-bis[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]phosphorylbut-3-ene-1-thiol Formula: C24H45O3PS MolecularWeight: 444.651061

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(C(CC=C)S)OC2CC(CCC2C(C)C)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OP(=O)([C@H](CC=C)S)O[C@@H]2C[C@@H](CC[C@H]2C(C)C)C)C(C)C

InChI

InChI=1S/C24H45O3PS/c1-8-9-24(29)28(25,26-22-14-18(6)10-12-20(22)16(2)3)27-23-15-19(7)11-13-21(23)17(4)5/h8,16-24,29H,1,9-15H2,2-7H3/t18-,19-,20+,21+,22-,23-,24+/m1/s1