methyl 4-methyl-3-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzoate

Systemtic Name: methyl 4-methyl-3-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzoate CAS Name: 4-methyl-3-[[2-(3-pyridinyl)-6-(trifluoromethyl)-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-pyridin-3-yl-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzoate Traditional Name: 4-methyl-3-[[2-(3-pyridyl)-6-(trifluoromethyl)pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C19H15F3N4O2 MolecularWeight: 388.34321

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC2=NC(=NC(=C2)C(F)(F)F)C3=CN=CC=C3

InChI

InChI=1S/C19H15F3N4O2/c1-11-5-6-12(18(27)28-2)8-14(11)24-16-9-15(19(20,21)22)25-17(26-16)13-4-3-7-23-10-13/h3-10H,1-2H3,(H,24,25,26)