5-hexyl-4-(4-methoxyphenyl)-1,2-dithiole-3-thione

Systemtic Name: 5-hexyl-4-(4-methoxyphenyl)-1,2-dithiole-3-thione Openeye Name: 5-hexyl-4-(4-methoxyphenyl)dithiole-3-thione CAS Name: 5-hexyl-4-(4-methoxyphenyl)-3-dithiolethione IUPAC Name: 5-hexyl-4-(4-methoxyphenyl)dithiole-3-thione Traditional Name: 5-hexyl-4-(4-methoxyphenyl)dithiole-3-thione Formula: C16H20OS3 MolecularWeight: 324.5244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=S)SS1)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCC1=C(C(=S)SS1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H20OS3/c1-3-4-5-6-7-14-15(16(18)20-19-14)12-8-10-13(17-2)11-9-12/h8-11H,3-7H2,1-2H3