[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenylsulfanyl-phosphoryl]benzene

Systemtic Name: [[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-phenylsulfanyl-phosphoryl]benzene Openeye Name: [[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-phenylsulfanyl-phosphoryl]benzene CAS Name: [[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-(phenylthio)phosphoryl]benzene IUPAC Name: [[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-phenylsulfanylphosphoryl]benzene Traditional Name: [[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-(phenylthio)phosphoryl]benzene Formula: C22H29O2PS MolecularWeight: 388.503221

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OP(=O)(C2=CC=CC=C2)SC3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O[P@](=O)(C2=CC=CC=C2)SC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C22H29O2PS/c1-17(2)21-15-14-18(3)16-22(21)24-25(23,19-10-6-4-7-11-19)26-20-12-8-5-9-13-20/h4-13,17-18,21-22H,14-16H2,1-3H3/t18-,21+,22-,25-/m1/s1