2-(2-azanylethylamino)-4-[[3-(trifluoromethyl)phenyl]amino]pyrimidine-5-carboxamide

Systemtic Name: 2-(2-azanylethylamino)-4-[[3-(trifluoromethyl)phenyl]amino]pyrimidine-5-carboxamide Openeye Name: 2-(2-aminoethylamino)-4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxamide CAS Name: 2-(2-aminoethylamino)-4-[3-(trifluoromethyl)anilino]-5-pyrimidinecarboxamide IUPAC Name: 2-(2-aminoethylamino)-4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxamide Traditional Name: 2-(2-aminoethylamino)-4-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxamide Formula: C14H15F3N6O MolecularWeight: 340.30371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC=C2C(=O)N)NCCN)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC=C2C(=O)N)NCCN)C(F)(F)F

InChI

InChI=1S/C14H15F3N6O/c15-14(16,17)8-2-1-3-9(6-8)22-12-10(11(19)24)7-21-13(23-12)20-5-4-18/h1-3,6-7H,4-5,18H2,(H2,19,24)(H2,20,21,22,23)