(2S)-1-(5-tert-butyl-2-methyl-phenyl)sulfanyl-3-[(4-chlorophenyl)methoxy]propan-2-ol

Systemtic Name: (2S)-1-(5-tert-butyl-2-methyl-phenyl)sulfanyl-3-[(4-chlorophenyl)methoxy]propan-2-ol Openeye Name: (2S)-1-(5-tert-butyl-2-methyl-phenyl)sulfanyl-3-[(4-chlorophenyl)methoxy]propan-2-ol CAS Name: (2S)-1-[(5-tert-butyl-2-methylphenyl)thio]-3-[(4-chlorophenyl)methoxy]-2-propanol IUPAC Name: (2S)-1-(5-tert-butyl-2-methylphenyl)sulfanyl-3-[(4-chlorophenyl)methoxy]propan-2-ol Traditional Name: (2S)-1-[(5-tert-butyl-2-methyl-phenyl)thio]-3-(4-chlorobenzyl)oxy-propan-2-ol Formula: C21H27ClO2S MolecularWeight: 378.95588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)SCC(COCC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)SC[C@H](COCC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C21H27ClO2S/c1-15-5-8-17(21(2,3)4)11-20(15)25-14-19(23)13-24-12-16-6-9-18(22)10-7-16/h5-11,19,23H,12-14H2,1-4H3/t19-/m0/s1