4-[(7-bromanyl-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboximidamide

Systemtic Name: 4-[(7-bromanyl-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboximidamide Openeye Name: 4-[(7-bromo-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-methylsulfanyl-thiophene-2-carboxamidine CAS Name: 4-[(7-bromo-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-(methylthio)-2-thiophenecarboximidamide IUPAC Name: 4-[(7-bromo-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-methylsulfanylthiophene-2-carboximidamide Traditional Name: 4-[(7-bromo-3-phenyl-1H-benzimidazol-3-ium-5-yl)sulfonyl]-5-(methylthio)thiophene-2-carboxamidine Formula: C19H16BrN4O2S3+ MolecularWeight: 508.45494

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C3C(=C2)[N+](=CN3)C4=CC=CC=C4)Br

Isomeric SMILES

CSC1=C(C=C(S1)C(=N)N)S(=O)(=O)C2=CC(=C3C(=C2)[N+](=CN3)C4=CC=CC=C4)Br

InChI

InChI=1S/C19H15BrN4O2S3/c1-27-19-16(9-15(28-19)18(21)22)29(25,26)12-7-13(20)17-14(8-12)24(10-23-17)11-5-3-2-4-6-11/h2-10H,1H3,(H3,21,22)/p+1