N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-pyrimidin-2-yl-ethane-1,2-diamine

Systemtic Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-pyrimidin-2-yl-ethane-1,2-diamine Openeye Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-pyrimidin-2-yl-ethane-1,2-diamine CAS Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-(2-pyrimidinyl)ethane-1,2-diamine IUPAC Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-pyrimidin-2-ylethane-1,2-diamine Traditional Name: 2-[2-nitro-4-(trifluoromethyl)anilino]ethyl-(2-pyrimidyl)amine Formula: C13H12F3N5O2 MolecularWeight: 327.26189

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)NCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H12F3N5O2/c14-13(15,16)9-2-3-10(11(8-9)21(22)23)17-6-7-20-12-18-4-1-5-19-12/h1-5,8,17H,6-7H2,(H,18,19,20)