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

Systemtic Name: 5-hexyl-4-[(4-methoxyphenyl)methyl]-1,2-dithiole-3-thione Openeye Name: 5-hexyl-4-[(4-methoxyphenyl)methyl]dithiole-3-thione CAS Name: 5-hexyl-4-[(4-methoxyphenyl)methyl]-3-dithiolethione IUPAC Name: 5-hexyl-4-[(4-methoxyphenyl)methyl]dithiole-3-thione Traditional Name: 5-hexyl-4-p-anisyl-dithiole-3-thione Formula: C17H22OS3 MolecularWeight: 338.55098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=S)SS1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCC1=C(C(=S)SS1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H22OS3/c1-3-4-5-6-7-16-15(17(19)21-20-16)12-13-8-10-14(18-2)11-9-13/h8-11H,3-7,12H2,1-2H3