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

Systemtic Name: 2-[(4-chloranyl-3-methoxy-phenyl)amino]-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: 2-(4-chloro-3-methoxy-anilino)-N-(tetrahydropyran-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: 2-(4-chloro-3-methoxyanilino)-N-(4-oxanylmethyl)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(4-chloro-3-methoxyanilino)-N-(oxan-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: 2-(4-chloro-3-methoxy-anilino)-N-(tetrahydropyran-4-ylmethyl)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C19H20ClF3N4O3 MolecularWeight: 444.83531

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=C(C(=N2)C(F)(F)F)C(=O)NCC3CCOCC3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=C(C(=N2)C(F)(F)F)C(=O)NCC3CCOCC3)Cl

InChI

InChI=1S/C19H20ClF3N4O3/c1-29-15-8-12(2-3-14(15)20)26-18-25-10-13(16(27-18)19(21,22)23)17(28)24-9-11-4-6-30-7-5-11/h2-3,8,10-11H,4-7,9H2,1H3,(H,24,28)(H,25,26,27)