6-(2-tert-butylhydrazinyl)-N-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(2-tert-butylhydrazinyl)-N-[4-chloranyl-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-(2-tert-butylhydrazino)-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-pyrimidin-4-amine CAS Name: 6-(tert-butylhydrazo)-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(2-tert-butylhydrazinyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]-5-nitropyrimidin-4-amine Traditional Name: [6-(N'-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]-[4-chloro-3-(trifluoromethyl)phenyl]amine Formula: C15H16ClF3N6O2 MolecularWeight: 404.77475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(C)(C)NNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C15H16ClF3N6O2/c1-14(2,3)24-23-13-11(25(26)27)12(20-7-21-13)22-8-4-5-10(16)9(6-8)15(17,18)19/h4-7,24H,1-3H3,(H2,20,21,22,23)