(2S,4R)-2,4-dimethyl-5-phenylsulfanyl-pentan-1-ol

Systemtic Name: (2S,4R)-2,4-dimethyl-5-phenylsulfanyl-pentan-1-ol Openeye Name: (2S,4R)-2,4-dimethyl-5-phenylsulfanyl-pentan-1-ol CAS Name: (2S,4R)-2,4-dimethyl-5-(phenylthio)-1-pentanol IUPAC Name: (2S,4R)-2,4-dimethyl-5-phenylsulfanylpentan-1-ol Traditional Name: (2S,4R)-2,4-dimethyl-5-(phenylthio)pentan-1-ol Formula: C13H20OS MolecularWeight: 224.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)CSC1=CC=CC=C1)CO

Isomeric SMILES

C[C@@H](C[C@@H](C)CSC1=CC=CC=C1)CO

InChI

InChI=1S/C13H20OS/c1-11(9-14)8-12(2)10-15-13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3/t11-,12+/m0/s1