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

Systemtic Name: N-(cyclopentylmethyl)-2-[(3-fluorophenyl)amino]-4-(trifluoromethyl)pyrimidine-5-carboxamide Openeye Name: N-(cyclopentylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide CAS Name: N-(cyclopentylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)-5-pyrimidinecarboxamide IUPAC Name: N-(cyclopentylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide Traditional Name: N-(cyclopentylmethyl)-2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidine-5-carboxamide Formula: C18H18F4N4O MolecularWeight: 382.355333

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)F

Isomeric SMILES

C1CCC(C1)CNC(=O)C2=CN=C(N=C2C(F)(F)F)NC3=CC(=CC=C3)F

InChI

InChI=1S/C18H18F4N4O/c19-12-6-3-7-13(8-12)25-17-24-10-14(15(26-17)18(20,21)22)16(27)23-9-11-4-1-2-5-11/h3,6-8,10-11H,1-2,4-5,9H2,(H,23,27)(H,24,25,26)