(2R,3S,4S)-4-methyl-3,5,5-tris(phenylsulfanyl)heptan-2-ol

Systemtic Name: (2R,3S,4S)-4-methyl-3,5,5-tris(phenylsulfanyl)heptan-2-ol Openeye Name: (2R,3S,4S)-4-methyl-3,5,5-tris(phenylsulfanyl)heptan-2-ol CAS Name: (2R,3S,4S)-4-methyl-3,5,5-tris(phenylthio)-2-heptanol IUPAC Name: (2R,3S,4S)-4-methyl-3,5,5-tris(phenylsulfanyl)heptan-2-ol Traditional Name: (2R,3S,4S)-4-methyl-3,5,5-tris(phenylthio)heptan-2-ol Formula: C26H30OS3 MolecularWeight: 454.7108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C(C(C)O)SC1=CC=CC=C1)(SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCC([C@@H](C)[C@@H]([C@@H](C)O)SC1=CC=CC=C1)(SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C26H30OS3/c1-4-26(29-23-16-10-6-11-17-23,30-24-18-12-7-13-19-24)20(2)25(21(3)27)28-22-14-8-5-9-15-22/h5-21,25,27H,4H2,1-3H3/t20-,21+,25-/m0/s1