2-hexyl-4-(4-methylphenyl)sulfanyl-1,3-benzodioxole

Systemtic Name: 2-hexyl-4-(4-methylphenyl)sulfanyl-1,3-benzodioxole Openeye Name: 2-hexyl-4-(p-tolylsulfanyl)-1,3-benzodioxole CAS Name: 2-hexyl-4-[(4-methylphenyl)thio]-1,3-benzodioxole IUPAC Name: 2-hexyl-4-(4-methylphenyl)sulfanyl-1,3-benzodioxole Traditional Name: 2-hexyl-4-(p-tolylthio)-1,3-benzodioxole Formula: C20H24O2S MolecularWeight: 328.46836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1OC2=C(O1)C(=CC=C2)SC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCC1OC2=C(O1)C(=CC=C2)SC3=CC=C(C=C3)C

InChI

InChI=1S/C20H24O2S/c1-3-4-5-6-10-19-21-17-8-7-9-18(20(17)22-19)23-16-13-11-15(2)12-14-16/h7-9,11-14,19H,3-6,10H2,1-2H3