3-[4-(3-methylphenoxy)butyl]-2-sulfanyl-phenol

Systemtic Name: 3-[4-(3-methylphenoxy)butyl]-2-sulfanyl-phenol Openeye Name: 3-[4-(3-methylphenoxy)butyl]-2-sulfanyl-phenol CAS Name: 2-mercapto-3-[4-(3-methylphenoxy)butyl]phenol IUPAC Name: 3-[4-(3-methylphenoxy)butyl]-2-sulfanylphenol Traditional Name: 2-mercapto-3-[4-(3-methylphenoxy)butyl]phenol Formula: C17H20O2S MolecularWeight: 288.4045

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCC2=C(C(=CC=C2)O)S

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCC2=C(C(=CC=C2)O)S

InChI

InChI=1S/C17H20O2S/c1-13-6-4-9-15(12-13)19-11-3-2-7-14-8-5-10-16(18)17(14)20/h4-6,8-10,12,18,20H,2-3,7,11H2,1H3