1-butyl-2-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl]sulfanyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl]thio]-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl]sulfanyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl]thio]-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C21H25N5O3S3 MolecularWeight: 491.6499

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)C(C#N)C3=NC(=CS3)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SCC(=O)C(C#N)C3=NC(=CS3)C

InChI

InChI=1S/C21H25N5O3S3/c1-5-6-9-26-18-8-7-15(32(28,29)25(3)4)10-17(18)24-21(26)31-13-19(27)16(11-22)20-23-14(2)12-30-20/h7-8,10,12,16H,5-6,9,13H2,1-4H3