N-butyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide

Systemtic Name: N-butyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide Openeye Name: N-butyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-3H-benzimidazole-5-sulfonamide CAS Name: N-butyl-2-[[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]thio]-3H-benzimidazole-5-sulfonamide IUPAC Name: N-butyl-2-[2-(2-methyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-3H-benzimidazole-5-sulfonamide Traditional Name: N-butyl-2-[[2-keto-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-3H-benzimidazole-5-sulfonamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C22H24N4O3S2/c1-3-4-11-23-31(28,29)15-9-10-18-19(12-15)26-22(25-18)30-13-20(27)21-14(2)24-17-8-6-5-7-16(17)21/h5-10,12,23-24H,3-4,11,13H2,1-2H3,(H,25,26)