N-(cyclohexylmethyl)-2-[(3-fluorophenyl)amino]-4-(trifluoromethyl)pyrimidine-5-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-2-[(3-fluorophenyl)amino]-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: N-(cyclohexylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: N-(cyclohexylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: N-(cyclohexylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: N-(cyclohexylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C19H20F4N4O MolecularWeight: 396.381913

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H20F4N4O/c20-13-7-4-8-14(9-13)26-18-25-11-15(16(27-18)19(21,22)23)17(28)24-10-12-5-2-1-3-6-12/h4,7-9,11-12H,1-3,5-6,10H2,(H,24,28)(H,25,26,27)