5-nitro-4-(phenylsulfonylmethyl)-2-(trifluoromethyl)-1H-benzimidazole

Systemtic Name: 5-nitro-4-(phenylsulfonylmethyl)-2-(trifluoromethyl)-1H-benzimidazole Openeye Name: 4-(benzenesulfonylmethyl)-5-nitro-2-(trifluoromethyl)-1H-benzimidazole CAS Name: 4-(benzenesulfonylmethyl)-5-nitro-2-(trifluoromethyl)-1H-benzimidazole IUPAC Name: 4-(benzenesulfonylmethyl)-5-nitro-2-(trifluoromethyl)-1H-benzimidazole Traditional Name: 4-(besylmethyl)-5-nitro-2-(trifluoromethyl)-1H-benzimidazole Formula: C15H10F3N3O4S MolecularWeight: 385.31781

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC3=C2N=C(N3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=C(C=CC3=C2N=C(N3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H10F3N3O4S/c16-15(17,18)14-19-11-6-7-12(21(22)23)10(13(11)20-14)8-26(24,25)9-4-2-1-3-5-9/h1-7H,8H2,(H,19,20)