2-[(4-carbamimidoylphenyl)amino]-N-(dimethylsulfamoyl)-2-(2-ethanoyl-7-iodanyl-1-benzofuran-5-yl)ethanamide

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-N-(dimethylsulfamoyl)-2-(2-ethanoyl-7-iodanyl-1-benzofuran-5-yl)ethanamide Openeye Name: 2-(2-acetyl-7-iodo-benzofuran-5-yl)-2-(4-carbamimidoylanilino)-N-(dimethylsulfamoyl)acetamide CAS Name: 2-(2-acetyl-7-iodo-5-benzofuranyl)-2-(4-carbamimidoylanilino)-N-(dimethylsulfamoyl)acetamide IUPAC Name: 2-(2-acetyl-7-iodo-1-benzofuran-5-yl)-2-(4-carbamimidoylanilino)-N-(dimethylsulfamoyl)acetamide Traditional Name: 2-(2-acetyl-7-iodo-benzofuran-5-yl)-2-(4-amidinoanilino)-N-(dimethylsulfamoyl)acetamide Formula: C21H22IN5O5S MolecularWeight: 583.39935

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=CC(=CC(=C2O1)I)C(C(=O)NS(=O)(=O)N(C)C)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(=O)C1=CC2=CC(=CC(=C2O1)I)C(C(=O)NS(=O)(=O)N(C)C)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H22IN5O5S/c1-11(28)17-10-14-8-13(9-16(22)19(14)32-17)18(21(29)26-33(30,31)27(2)3)25-15-6-4-12(5-7-15)20(23)24/h4-10,18,25H,1-3H3,(H3,23,24)(H,26,29)