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

Systemtic Name: 2-[(4-iodophenyl)amino]-5-(3-oxidanylpropyl)-4-(pyridin-3-ylmethyl)-3-sulfamoyl-benzamide Openeye Name: 5-(3-hydroxypropyl)-2-(4-iodoanilino)-4-(3-pyridylmethyl)-3-sulfamoyl-benzamide CAS Name: 5-(3-hydroxypropyl)-2-(4-iodoanilino)-4-(3-pyridinylmethyl)-3-sulfamoylbenzamide IUPAC Name: 5-(3-hydroxypropyl)-2-(4-iodoanilino)-4-(pyridin-3-ylmethyl)-3-sulfamoylbenzamide Traditional Name: 5-(3-hydroxypropyl)-2-(4-iodoanilino)-4-(3-pyridylmethyl)-3-sulfamoyl-benzamide Formula: C22H23IN4O4S MolecularWeight: 566.41189

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=C(C=C(C(=C2S(=O)(=O)N)NC3=CC=C(C=C3)I)C(=O)N)CCCO

Isomeric SMILES

C1=CC(=CN=C1)CC2=C(C=C(C(=C2S(=O)(=O)N)NC3=CC=C(C=C3)I)C(=O)N)CCCO

InChI

InChI=1S/C22H23IN4O4S/c23-16-5-7-17(8-6-16)27-20-19(22(24)29)12-15(4-2-10-28)18(21(20)32(25,30)31)11-14-3-1-9-26-13-14/h1,3,5-9,12-13,27-28H,2,4,10-11H2,(H2,24,29)(H2,25,30,31)