4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-chloranyl-N-methyl-benzamide

Systemtic Name: 4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-chloranyl-N-methyl-benzamide Openeye Name: 4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-chloro-N-methyl-benzamide CAS Name: 4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2-chloro-N-methylbenzamide IUPAC Name: 4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-chloro-N-methylbenzamide Traditional Name: 4-[[4-(2-acetamidoethylamino)-5-(trifluoromethyl)pyrimidin-2-yl]amino]-2-chloro-N-methyl-benzamide Formula: C17H18ClF3N6O2 MolecularWeight: 430.81203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC=C1C(F)(F)F)NC2=CC(=C(C=C2)C(=O)NC)Cl

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC=C1C(F)(F)F)NC2=CC(=C(C=C2)C(=O)NC)Cl

InChI

InChI=1S/C17H18ClF3N6O2/c1-9(28)23-5-6-24-14-12(17(19,20)21)8-25-16(27-14)26-10-3-4-11(13(18)7-10)15(29)22-2/h3-4,7-8H,5-6H2,1-2H3,(H,22,29)(H,23,28)(H2,24,25,26,27)