4-(2,2-dimethylpropyl)-5-[(3-dodecylphenyl)methylsulfanyl]-1,2-dithiole-3-thione

Systemtic Name: 4-(2,2-dimethylpropyl)-5-[(3-dodecylphenyl)methylsulfanyl]-1,2-dithiole-3-thione Openeye Name: 4-(2,2-dimethylpropyl)-5-[(3-dodecylphenyl)methylsulfanyl]dithiole-3-thione CAS Name: 4-(2,2-dimethylpropyl)-5-[(3-dodecylphenyl)methylthio]-3-dithiolethione IUPAC Name: 4-(2,2-dimethylpropyl)-5-[(3-dodecylphenyl)methylsulfanyl]dithiole-3-thione Traditional Name: 5-[(3-laurylbenzyl)thio]-4-neopentyl-dithiole-3-thione Formula: C27H42S4 MolecularWeight: 494.88238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC(=CC=C1)CSC2=C(C(=S)SS2)CC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC(=CC=C1)CSC2=C(C(=S)SS2)CC(C)(C)C

InChI

InChI=1S/C27H42S4/c1-5-6-7-8-9-10-11-12-13-14-16-22-17-15-18-23(19-22)21-29-26-24(20-27(2,3)4)25(28)30-31-26/h15,17-19H,5-14,16,20-21H2,1-4H3