N6-[3,4-bis(fluoranyl)phenyl]-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-[3,4-bis(fluoranyl)phenyl]-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(3,4-difluorophenyl)-N4-(2-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(3,4-difluorophenyl)-N4-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(3,4-difluorophenyl)-4-N-(2-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(3,4-difluoroanilino)-5-nitro-pyrimidin-4-yl]-(2-methoxyphenyl)amine Formula: C17H13F2N5O3 MolecularWeight: 373.313626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)F

Isomeric SMILES

COC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C17H13F2N5O3/c1-27-14-5-3-2-4-13(14)23-17-15(24(25)26)16(20-9-21-17)22-10-6-7-11(18)12(19)8-10/h2-9H,1H3,(H2,20,21,22,23)