5-(2-hydroxyethyl)-2-[(4-iodophenyl)amino]-4-(pyridin-2-ylmethyl)-3-sulfamoyl-benzamide

Systemtic Name: 5-(2-hydroxyethyl)-2-[(4-iodophenyl)amino]-4-(pyridin-2-ylmethyl)-3-sulfamoyl-benzamide Openeye Name: 5-(2-hydroxyethyl)-2-(4-iodoanilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide CAS Name: 5-(2-hydroxyethyl)-2-(4-iodoanilino)-4-(2-pyridinylmethyl)-3-sulfamoylbenzamide IUPAC Name: 5-(2-hydroxyethyl)-2-(4-iodoanilino)-4-(pyridin-2-ylmethyl)-3-sulfamoylbenzamide Traditional Name: 5-(2-hydroxyethyl)-2-(4-iodoanilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide Formula: C21H21IN4O4S MolecularWeight: 552.38531

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CC2=C(C=C(C(=C2S(=O)(=O)N)NC3=CC=C(C=C3)I)C(=O)N)CCO

Isomeric SMILES

C1=CC=NC(=C1)CC2=C(C=C(C(=C2S(=O)(=O)N)NC3=CC=C(C=C3)I)C(=O)N)CCO

InChI

InChI=1S/C21H21IN4O4S/c22-14-4-6-15(7-5-14)26-19-18(21(23)28)11-13(8-10-27)17(20(19)31(24,29)30)12-16-3-1-2-9-25-16/h1-7,9,11,26-27H,8,10,12H2,(H2,23,28)(H2,24,29,30)