N6-[3,4-bis(fluoranyl)phenyl]-N4-tert-butyl-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[3,4-bis(fluoranyl)phenyl]-N4-tert-butyl-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-N6-(3,4-difluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-N6-(3,4-difluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-6-N-(3,4-difluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: tert-butyl-[6-(3,4-difluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H15F2N5O2 MolecularWeight: 323.298006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)F)F

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC(=C(C=C2)F)F

InChI

InChI=1S/C14H15F2N5O2/c1-14(2,3)20-13-11(21(22)23)12(17-7-18-13)19-8-4-5-9(15)10(16)6-8/h4-7H,1-3H3,(H2,17,18,19,20)