4-[6-bromanyl-1-(4-methylphenyl)sulfanyl-hexyl]-1,2-dimethoxy-benzene

Systemtic Name: 4-[6-bromanyl-1-(4-methylphenyl)sulfanyl-hexyl]-1,2-dimethoxy-benzene Openeye Name: 4-[6-bromo-1-(p-tolylsulfanyl)hexyl]-1,2-dimethoxy-benzene CAS Name: 4-[6-bromo-1-[(4-methylphenyl)thio]hexyl]-1,2-dimethoxybenzene IUPAC Name: 4-[6-bromo-1-(4-methylphenyl)sulfanylhexyl]-1,2-dimethoxybenzene Traditional Name: 4-[6-bromo-1-(p-tolylthio)hexyl]-1,2-dimethoxy-benzene Formula: C21H27BrO2S MolecularWeight: 423.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCCCCBr)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCCCCBr)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H27BrO2S/c1-16-8-11-18(12-9-16)25-21(7-5-4-6-14-22)17-10-13-19(23-2)20(15-17)24-3/h8-13,15,21H,4-7,14H2,1-3H3