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

Systemtic Name: 2-[(4-iodanyl-2-methyl-phenyl)amino]-5-(3-oxidanylpropyl)-4-(pyridin-2-ylmethyl)-3-sulfamoyl-benzamide Openeye Name: 5-(3-hydroxypropyl)-2-(4-iodo-2-methyl-anilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide CAS Name: 5-(3-hydroxypropyl)-2-(4-iodo-2-methylanilino)-4-(2-pyridinylmethyl)-3-sulfamoylbenzamide IUPAC Name: 5-(3-hydroxypropyl)-2-(4-iodo-2-methylanilino)-4-(pyridin-2-ylmethyl)-3-sulfamoylbenzamide Traditional Name: 5-(3-hydroxypropyl)-2-(4-iodo-2-methyl-anilino)-4-(2-pyridylmethyl)-3-sulfamoyl-benzamide Formula: C23H25IN4O4S MolecularWeight: 580.43847

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25IN4O4S/c1-14-11-16(24)7-8-20(14)28-21-19(23(25)30)12-15(5-4-10-29)18(22(21)33(26,31)32)13-17-6-2-3-9-27-17/h2-3,6-9,11-12,28-29H,4-5,10,13H2,1H3,(H2,25,30)(H2,26,31,32)