4-bromanyl-N-(1,3-dimethyl-2-oxidanylidene-6-phenylsulfanyl-benzimidazol-5-yl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(1,3-dimethyl-2-oxidanylidene-6-phenylsulfanyl-benzimidazol-5-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(1,3-dimethyl-2-oxo-6-phenylsulfanyl-benzimidazol-5-yl)benzenesulfonamide CAS Name: 4-bromo-N-[1,3-dimethyl-2-oxo-6-(phenylthio)-5-benzimidazolyl]benzenesulfonamide IUPAC Name: 4-bromo-N-(1,3-dimethyl-2-oxo-6-phenylsulfanylbenzimidazol-5-yl)benzenesulfonamide Traditional Name: 4-bromo-N-[2-keto-1,3-dimethyl-6-(phenylthio)benzimidazol-5-yl]benzenesulfonamide Formula: C21H18BrN3O3S2 MolecularWeight: 504.41992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)SC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)SC3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3O3S2/c1-24-18-12-17(23-30(27,28)16-10-8-14(22)9-11-16)20(13-19(18)25(2)21(24)26)29-15-6-4-3-5-7-15/h3-13,23H,1-2H3