5-(4-methylphenyl)-1-sulfanyl-pentan-2-ol

Systemtic Name: 5-(4-methylphenyl)-1-sulfanyl-pentan-2-ol Openeye Name: 5-(p-tolyl)-1-sulfanyl-pentan-2-ol CAS Name: 1-mercapto-5-(4-methylphenyl)-2-pentanol IUPAC Name: 5-(4-methylphenyl)-1-sulfanylpentan-2-ol Traditional Name: 1-mercapto-5-(p-tolyl)pentan-2-ol Formula: C12H18OS MolecularWeight: 210.33572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCC(CS)O

Isomeric SMILES

CC1=CC=C(C=C1)CCCC(CS)O

InChI

InChI=1S/C12H18OS/c1-10-5-7-11(8-6-10)3-2-4-12(13)9-14/h5-8,12-14H,2-4,9H2,1H3