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

Systemtic Name: N6-[3,4-bis(fluoranyl)phenyl]-N4-(diphenylmethyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-benzhydryl-N6-(3,4-difluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3,4-difluorophenyl)-N4-(diphenylmethyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-benzhydryl-6-N-(3,4-difluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzhydryl-[6-(3,4-difluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C23H17F2N5O2 MolecularWeight: 433.410186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=C(C=C4)F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C23H17F2N5O2/c24-18-12-11-17(13-19(18)25)28-22-21(30(31)32)23(27-14-26-22)29-20(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14,20H,(H2,26,27,28,29)