2-[2-[2,5-bis(chloranyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-1-butyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-[2,5-bis(chloranyl)phenyl]-2-oxidanylidene-ethyl]sulfanyl-1-butyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[2-(2,5-dichlorophenyl)-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[2-(2,5-dichlorophenyl)-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[2-(2,5-dichlorophenyl)-2-oxoethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[2-(2,5-dichlorophenyl)-2-keto-ethyl]thio]benzimidazole-5-sulfonamide Formula: C19H19Cl2N3O3S2 MolecularWeight: 472.40846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C19H19Cl2N3O3S2/c1-2-3-8-24-17-7-5-13(29(22,26)27)10-16(17)23-19(24)28-11-18(25)14-9-12(20)4-6-15(14)21/h4-7,9-10H,2-3,8,11H2,1H3,(H2,22,26,27)