2-tert-butyl-4-(phenylmethylsulfanyl)butane-1,3-diol

Systemtic Name: 2-tert-butyl-4-(phenylmethylsulfanyl)butane-1,3-diol Openeye Name: 4-benzylsulfanyl-2-tert-butyl-butane-1,3-diol CAS Name: 2-tert-butyl-4-(phenylmethylthio)butane-1,3-diol IUPAC Name: 4-benzylsulfanyl-2-tert-butylbutane-1,3-diol Traditional Name: 4-(benzylthio)-2-tert-butyl-butane-1,3-diol Formula: C15H24O2S MolecularWeight: 268.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CO)C(CSCC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)C(CO)C(CSCC1=CC=CC=C1)O

InChI

InChI=1S/C15H24O2S/c1-15(2,3)13(9-16)14(17)11-18-10-12-7-5-4-6-8-12/h4-8,13-14,16-17H,9-11H2,1-3H3