6-methylhepta-1,5-dien-4-ylsulfanylbenzene

Systemtic Name: 6-methylhepta-1,5-dien-4-ylsulfanylbenzene Openeye Name: (1-allyl-3-methyl-but-2-enyl)sulfanylbenzene CAS Name: (6-methylhepta-1,5-dien-4-ylthio)benzene IUPAC Name: 6-methylhepta-1,5-dien-4-ylsulfanylbenzene Traditional Name: [(1-allyl-3-methyl-but-2-enyl)thio]benzene Formula: C14H18S MolecularWeight: 218.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(CC=C)SC1=CC=CC=C1)C

Isomeric SMILES

CC(=CC(CC=C)SC1=CC=CC=C1)C

InChI

InChI=1S/C14H18S/c1-4-8-14(11-12(2)3)15-13-9-6-5-7-10-13/h4-7,9-11,14H,1,8H2,2-3H3