2-[(4-iodophenyl)-methylsulfonyl-amino]-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]ethanamide

Systemtic Name: 2-[(4-iodophenyl)-methylsulfonyl-amino]-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]ethanamide Openeye Name: 2-(4-iodo-N-methylsulfonyl-anilino)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide CAS Name: 2-(4-iodo-N-methylsulfonylanilino)-N-[[4-(2-methyl-1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-iodo-N-methylsulfonylanilino)-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide Traditional Name: 2-(4-iodo-N-mesyl-anilino)-N-[4-(2-methylimidazol-1-yl)benzyl]acetamide Formula: C20H21IN4O3S MolecularWeight: 524.37521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)CN(C3=CC=C(C=C3)I)S(=O)(=O)C

Isomeric SMILES

CC1=NC=CN1C2=CC=C(C=C2)CNC(=O)CN(C3=CC=C(C=C3)I)S(=O)(=O)C

InChI

InChI=1S/C20H21IN4O3S/c1-15-22-11-12-24(15)18-7-3-16(4-8-18)13-23-20(26)14-25(29(2,27)28)19-9-5-17(21)6-10-19/h3-12H,13-14H2,1-2H3,(H,23,26)