5-(2-hydroxyethyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]-4-(pyridin-2-ylmethyl)-3-sulfamoyl-benzamide

Systemtic Name: 5-(2-hydroxyethyl)-2-[(4-iodanyl-2-methyl-phenyl)amino]-4-(pyridin-2-ylmethyl)-3-sulfamoyl-benzamide Openeye Name: 5-(2-hydroxyethyl)-2-(4-iodo-2-methyl-anilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide CAS Name: 5-(2-hydroxyethyl)-2-(4-iodo-2-methylanilino)-4-(2-pyridinylmethyl)-3-sulfamoylbenzamide IUPAC Name: 5-(2-hydroxyethyl)-2-(4-iodo-2-methylanilino)-4-(pyridin-2-ylmethyl)-3-sulfamoylbenzamide Traditional Name: 5-(2-hydroxyethyl)-2-(4-iodo-2-methyl-anilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide Formula: C22H23IN4O4S MolecularWeight: 566.41189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)N)CCO)CC3=CC=CC=N3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)N)CCO)CC3=CC=CC=N3)S(=O)(=O)N

InChI

InChI=1S/C22H23IN4O4S/c1-13-10-15(23)5-6-19(13)27-20-18(22(24)29)11-14(7-9-28)17(21(20)32(25,30)31)12-16-4-2-3-8-26-16/h2-6,8,10-11,27-28H,7,9,12H2,1H3,(H2,24,29)(H2,25,30,31)