4-[4-oxidanyl-3,5-bis(2,4,4-trimethylpentan-2-yl)phenyl]-1,2-dithiole-3-thione

Systemtic Name: 4-[4-oxidanyl-3,5-bis(2,4,4-trimethylpentan-2-yl)phenyl]-1,2-dithiole-3-thione Openeye Name: 4-[4-hydroxy-3,5-bis(1,1,3,3-tetramethylbutyl)phenyl]dithiole-3-thione CAS Name: 4-[4-hydroxy-3,5-bis(2,4,4-trimethylpentan-2-yl)phenyl]-3-dithiolethione IUPAC Name: 4-[4-hydroxy-3,5-bis(2,4,4-trimethylpentan-2-yl)phenyl]dithiole-3-thione Traditional Name: 4-[4-hydroxy-3,5-bis(1,1,3,3-tetramethylbutyl)phenyl]dithiole-3-thione Formula: C25H38OS3 MolecularWeight: 450.76362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC(C)(C)C)C2=CSSC2=S

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC(C)(C)C)C2=CSSC2=S

InChI

InChI=1S/C25H38OS3/c1-22(2,3)14-24(7,8)18-11-16(17-13-28-29-21(17)27)12-19(20(18)26)25(9,10)15-23(4,5)6/h11-13,26H,14-15H2,1-10H3