N4-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitropyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-pyrimidin-4-yl)-[4-chloro-3-(trifluoromethyl)phenyl]amine Formula: C11H7ClF3N5O2 MolecularWeight: 333.65379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N)C(F)(F)F)Cl

InChI

InChI=1S/C11H7ClF3N5O2/c12-7-2-1-5(3-6(7)11(13,14)15)19-10-8(20(21)22)9(16)17-4-18-10/h1-4H,(H3,16,17,18,19)