5-nitro-N4-propan-2-yl-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-propan-2-yl-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-5-nitro-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-propan-2-yl-N6-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-propan-2-yl-6-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,6-diamine Traditional Name: isopropyl-[5-nitro-6-[3-(trifluoromethyl)anilino]pyrimidin-4-yl]amine Formula: C14H14F3N5O2 MolecularWeight: 341.28847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H14F3N5O2/c1-8(2)20-12-11(22(23)24)13(19-7-18-12)21-10-5-3-4-9(6-10)14(15,16)17/h3-8H,1-2H3,(H2,18,19,20,21)