2-[[2,5-bis(fluoranyl)phenyl]sulfanylmethyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[2,5-bis(fluoranyl)phenyl]sulfanylmethyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide Openeye Name: 2-[(2,5-difluorophenyl)sulfanylmethyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide CAS Name: 2-[[(2,5-difluorophenyl)thio]methyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide IUPAC Name: 2-[(2,5-difluorophenyl)sulfanylmethyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide Traditional Name: 2-[[(2,5-difluorophenyl)thio]methyl]-N,N-diethyl-3H-benzimidazole-5-sulfonamide Formula: C18H19F2N3O2S2 MolecularWeight: 411.489166

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=C(C=CC(=C3)F)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(N2)CSC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C18H19F2N3O2S2/c1-3-23(4-2)27(24,25)13-6-8-15-16(10-13)22-18(21-15)11-26-17-9-12(19)5-7-14(17)20/h5-10H,3-4,11H2,1-2H3,(H,21,22)