2-[(3-chloranyl-2-methyl-phenyl)amino]-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[(3-chloranyl-2-methyl-phenyl)amino]-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: 2-(3-chloro-2-methyl-anilino)-N-(tetrahydropyran-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: 2-(3-chloro-2-methylanilino)-N-(4-oxanylmethyl)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(3-chloro-2-methylanilino)-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: 2-(3-chloro-2-methyl-anilino)-N-(tetrahydropyran-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C19H20ClF3N4O2 MolecularWeight: 428.83591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=NC=C(C(=N2)C(F)(F)F)C(=O)NCC3CCOCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=NC=C(C(=N2)C(F)(F)F)C(=O)NCC3CCOCC3

InChI

InChI=1S/C19H20ClF3N4O2/c1-11-14(20)3-2-4-15(11)26-18-25-10-13(16(27-18)19(21,22)23)17(28)24-9-12-5-7-29-8-6-12/h2-4,10,12H,5-9H2,1H3,(H,24,28)(H,25,26,27)