N-(4-bromanyl-2-fluoranyl-phenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(1-butyl-5-sulfamoyl-benzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(1-butyl-5-sulfamoyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(1-butyl-5-sulfamoylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(1-butyl-5-sulfamoyl-benzimidazol-2-yl)thio]acetamide Formula: C19H20BrFN4O3S2 MolecularWeight: 515.419503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C19H20BrFN4O3S2/c1-2-3-8-25-17-7-5-13(30(22,27)28)10-16(17)24-19(25)29-11-18(26)23-15-6-4-12(20)9-14(15)21/h4-7,9-10H,2-3,8,11H2,1H3,(H,23,26)(H2,22,27,28)