2-butan-2-yl-5,7,7-trimethyl-N-(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)octanamide

Systemtic Name: 2-butan-2-yl-5,7,7-trimethyl-N-(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)octanamide Openeye Name: 5,7,7-trimethyl-2-sec-butyl-N-(2-thioxo-1,3-dihydrobenzimidazol-5-yl)octanamide CAS Name: 2-butan-2-yl-5,7,7-trimethyl-N-(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)octanamide IUPAC Name: 2-butan-2-yl-5,7,7-trimethyl-N-(2-sulfanylidene-1,3-dihydrobenzimidazol-5-yl)octanamide Traditional Name: 5,7,7-trimethyl-2-sec-butyl-N-(2-thioxo-1,3-dihydrobenzimidazol-5-yl)caprylamide Formula: C22H35N3OS MolecularWeight: 389.5978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CCC(C)CC(C)(C)C)C(=O)NC1=CC2=C(C=C1)NC(=S)N2

Isomeric SMILES

CCC(C)C(CCC(C)CC(C)(C)C)C(=O)NC1=CC2=C(C=C1)NC(=S)N2

InChI

InChI=1S/C22H35N3OS/c1-7-15(3)17(10-8-14(2)13-22(4,5)6)20(26)23-16-9-11-18-19(12-16)25-21(27)24-18/h9,11-12,14-15,17H,7-8,10,13H2,1-6H3,(H,23,26)(H2,24,25,27)