(3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]sulfanylbenzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]sulfanylbenzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]thio]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]sulfanylbenzoate Traditional Name: 2-[[2-keto-2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]thio]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)NC(=O)N3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)NC(=O)N3

InChI

InChI=1S/C22H23N3O5S/c1-22(2,3)18(26)11-30-20(28)14-6-4-5-7-17(14)31-12-19(27)23-13-8-9-15-16(10-13)25-21(29)24-15/h4-10H,11-12H2,1-3H3,(H,23,27)(H2,24,25,29)