N-[4-chloranyl-3-(trifluoromethyl)phenyl]-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-imidazol-1-yl-5-nitro-pyrimidin-4-amine CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(1-imidazolyl)-5-nitro-4-pyrimidinamine IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-6-imidazol-1-yl-5-nitropyrimidin-4-amine Traditional Name: [4-chloro-3-(trifluoromethyl)phenyl]-(6-imidazol-1-yl-5-nitro-pyrimidin-4-yl)amine Formula: C14H8ClF3N6O2 MolecularWeight: 384.70053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC=NC(=C2[N+](=O)[O-])N3C=CN=C3)C(F)(F)F)Cl

InChI

InChI=1S/C14H8ClF3N6O2/c15-10-2-1-8(5-9(10)14(16,17)18)22-12-11(24(25)26)13(21-6-20-12)23-4-3-19-7-23/h1-7H,(H,20,21,22)