2-[2-[2-(4-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[2-[2-(4-fluorophenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[2-[2-(4-fluorobenzoyl)hydrazino]-2-oxo-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[2-[[(4-fluorophenyl)-oxomethyl]hydrazo]-2-oxoethyl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[2-[2-(4-fluorobenzoyl)hydrazinyl]-2-oxoethyl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[2-[N'-(4-fluorobenzoyl)hydrazino]-2-keto-ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C19H20FN5O4S2 MolecularWeight: 465.521603

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NNC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN5O4S2/c1-2-9-25-16-8-7-14(31(21,28)29)10-15(16)22-19(25)30-11-17(26)23-24-18(27)12-3-5-13(20)6-4-12/h3-8,10H,2,9,11H2,1H3,(H,23,26)(H,24,27)(H2,21,28,29)