2-[(3-chlorophenyl)amino]-N-methyl-N-(phenylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)amino]-N-methyl-N-(phenylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: N-benzyl-2-(3-chloroanilino)-N-methyl-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: 2-(3-chloroanilino)-N-methyl-N-(phenylmethyl)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: N-benzyl-2-(3-chloroanilino)-N-methyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: N-benzyl-2-(3-chloroanilino)-N-methyl-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C20H16ClF3N4O MolecularWeight: 420.81545

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H16ClF3N4O/c1-28(12-13-6-3-2-4-7-13)18(29)16-11-25-19(27-17(16)20(22,23)24)26-15-9-5-8-14(21)10-15/h2-11H,12H2,1H3,(H,25,26,27)