(2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenyl-piperidin-4-ol

Systemtic Name: (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenyl-piperidin-4-ol Openeye Name: (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenyl-piperidin-4-ol CAS Name: (2S,3R,4R,6R)-4-[2-(dipropoxyphosphorylthio)ethynyl]-3-methyl-2,6-diphenyl-4-piperidinol IUPAC Name: (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenylpiperidin-4-ol Traditional Name: (2S,3R,4R,6R)-4-[2-(dipropoxyphosphorylthio)ethynyl]-3-methyl-2,6-diphenyl-piperidin-4-ol Formula: C26H34NO4PS MolecularWeight: 487.591221

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(OCCC)SC#CC1(CC(NC(C1C)C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCCOP(=O)(OCCC)SC#C[C@]1(C[C@@H](N[C@@H]([C@H]1C)C2=CC=CC=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C26H34NO4PS/c1-4-17-30-32(29,31-18-5-2)33-19-16-26(28)20-24(22-12-8-6-9-13-22)27-25(21(26)3)23-14-10-7-11-15-23/h6-15,21,24-25,27-28H,4-5,17-18,20H2,1-3H3/t21-,24-,25+,26-/m1/s1