N4-(2-bromophenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-bromophenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-bromophenyl)-N6-(2-ethylphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-bromophenyl)-N6-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-bromophenyl)-6-N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-bromoanilino)-5-nitro-pyrimidin-4-yl]-(2-ethylphenyl)amine Formula: C18H16BrN5O2 MolecularWeight: 414.25594

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C18H16BrN5O2/c1-2-12-7-3-5-9-14(12)22-17-16(24(25)26)18(21-11-20-17)23-15-10-6-4-8-13(15)19/h3-11H,2H2,1H3,(H2,20,21,22,23)