N1-[4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-2-methyl-phenyl]-3-iodanyl-N2-(2-methyl-1-methylsulfonyl-propan-2-yl)benzene-1,2-dicarboxamide

Systemtic Name: N1-[4-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-2-methyl-phenyl]-3-iodanyl-N2-(2-methyl-1-methylsulfonyl-propan-2-yl)benzene-1,2-dicarboxamide Openeye Name: N2-(1,1-dimethyl-2-methylsulfonyl-ethyl)-3-iodo-N1-[2-methyl-4-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]phenyl]phthalamide CAS Name: N1-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methylphenyl]-3-iodo-N2-(2-methyl-1-methylsulfonylpropan-2-yl)benzene-1,2-dicarboxamide IUPAC Name: 1-N-[4-(1,1,1,3,3,3-hexafluoropropan-2-yl)-2-methylphenyl]-3-iodo-2-N-(2-methyl-1-methylsulfonylpropan-2-yl)benzene-1,2-dicarboxamide Traditional Name: 3-iodo-N'-(2-mesyl-1,1-dimethyl-ethyl)-N-[2-methyl-4-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]phenyl]phthalamide Formula: C23H23F6IN2O4S MolecularWeight: 664.399609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C(F)(F)F)C(F)(F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C(F)(F)F)C(F)(F)F)NC(=O)C2=C(C(=CC=C2)I)C(=O)NC(C)(C)CS(=O)(=O)C

InChI

InChI=1S/C23H23F6IN2O4S/c1-12-10-13(18(22(24,25)26)23(27,28)29)8-9-16(12)31-19(33)14-6-5-7-15(30)17(14)20(34)32-21(2,3)11-37(4,35)36/h5-10,18H,11H2,1-4H3,(H,31,33)(H,32,34)