1-butyl-2-[2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[2-[2-(furan-2-carbonyl)hydrazino]-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[2-[[2-furanyl(oxo)methyl]hydrazo]-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[2-[N'-(2-furoyl)hydrazino]-2-keto-ethyl]thio]benzimidazole-5-sulfonamide Formula: C18H21N5O5S2 MolecularWeight: 451.51984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NNC(=O)C3=CC=CO3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NNC(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N5O5S2/c1-2-3-8-23-14-7-6-12(30(19,26)27)10-13(14)20-18(23)29-11-16(24)21-22-17(25)15-5-4-9-28-15/h4-7,9-10H,2-3,8,11H2,1H3,(H,21,24)(H,22,25)(H2,19,26,27)