N,N,1-triethyl-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: N,N,1-triethyl-2-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: N,N,1-triethyl-2-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: N,N,1-triethyl-2-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: N,N,1-triethyl-2-[2-(4-fluorophenyl)-2-oxoethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: N,N,1-triethyl-2-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]benzimidazole-5-sulfonamide Formula: C21H24FN3O3S2 MolecularWeight: 449.561963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O3S2/c1-4-24(5-2)30(27,28)17-11-12-19-18(13-17)23-21(25(19)6-3)29-14-20(26)15-7-9-16(22)10-8-15/h7-13H,4-6,14H2,1-3H3