4-(2-hydroxyethyl)-2-[(4-iodophenyl)amino]-3-(pyridin-4-ylmethylsulfamoyl)benzamide

Systemtic Name: 4-(2-hydroxyethyl)-2-[(4-iodophenyl)amino]-3-(pyridin-4-ylmethylsulfamoyl)benzamide Openeye Name: 4-(2-hydroxyethyl)-2-(4-iodoanilino)-3-(4-pyridylmethylsulfamoyl)benzamide CAS Name: 4-(2-hydroxyethyl)-2-(4-iodoanilino)-3-(pyridin-4-ylmethylsulfamoyl)benzamide IUPAC Name: 4-(2-hydroxyethyl)-2-(4-iodoanilino)-3-(pyridin-4-ylmethylsulfamoyl)benzamide Traditional Name: 4-(2-hydroxyethyl)-2-(4-iodoanilino)-3-(4-pyridylmethylsulfamoyl)benzamide Formula: C21H21IN4O4S MolecularWeight: 552.38531

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=CC(=C2S(=O)(=O)NCC3=CC=NC=C3)CCO)C(=O)N)I

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=CC(=C2S(=O)(=O)NCC3=CC=NC=C3)CCO)C(=O)N)I

InChI

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