N-butyl-2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide

Systemtic Name: N-butyl-2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide Openeye Name: N-butyl-2-[2-(5-chloro-2-thienyl)-2-oxo-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide CAS Name: N-butyl-2-[[2-(5-chloro-2-thiophenyl)-2-oxoethyl]thio]-3H-benzimidazole-5-sulfonamide IUPAC Name: N-butyl-2-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]sulfanyl-3H-benzimidazole-5-sulfonamide Traditional Name: N-butyl-2-[[2-(5-chloro-2-thienyl)-2-keto-ethyl]thio]-3H-benzimidazole-5-sulfonamide Formula: C17H18ClN3O3S3 MolecularWeight: 443.99112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18ClN3O3S3/c1-2-3-8-19-27(23,24)11-4-5-12-13(9-11)21-17(20-12)25-10-14(22)15-6-7-16(18)26-15/h4-7,9,19H,2-3,8,10H2,1H3,(H,20,21)