N6-(oxolan-2-ylmethyl)-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine

Systemtic Name: N6-(oxolan-2-ylmethyl)-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Openeye Name: N6-(tetrahydrofuran-2-ylmethyl)-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine CAS Name: N6-(2-oxolanylmethyl)-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(oxolan-2-ylmethyl)-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(tetrahydrofurfurylamino)pyrimidin-4-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C16H18F3N5O MolecularWeight: 353.34223

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CC(OC1)CNC2=NC=NC(=C2N)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H18F3N5O/c17-16(18,19)10-3-1-4-11(7-10)24-15-13(20)14(22-9-23-15)21-8-12-5-2-6-25-12/h1,3-4,7,9,12H,2,5-6,8,20H2,(H2,21,22,23,24)