4-chloranyl-N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-methylsulfanyl-pyrimidin-5-amine

Systemtic Name: 4-chloranyl-N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-methylsulfanyl-pyrimidin-5-amine Openeye Name: 4-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-methylsulfanyl-pyrimidin-5-amine CAS Name: 4-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-(methylthio)-5-pyrimidinamine IUPAC Name: 4-chloro-N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-methylsulfanylpyrimidin-5-amine Traditional Name: [3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-[4-chloro-6-(methylthio)pyrimidin-5-yl]amine Formula: C12H6Cl2F3N5O4S MolecularWeight: 444.17335

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=NC=N1)Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C(=NC=N1)Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H6Cl2F3N5O4S/c1-27-11-8(10(14)18-3-19-11)20-7-5(21(23)24)2-4(12(15,16)17)6(13)9(7)22(25)26/h2-3,20H,1H3