N4-(5-bromanylpyridin-2-yl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(5-bromanylpyridin-2-yl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine Openeye Name: N4-(5-bromo-2-pyridyl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine CAS Name: N4-(5-bromo-2-pyridinyl)-5-nitro-N6-phenethylpyrimidine-4,6-diamine IUPAC Name: 4-N-(5-bromopyridin-2-yl)-5-nitro-6-N-phenethylpyrimidine-4,6-diamine Traditional Name: (5-bromo-2-pyridyl)-[5-nitro-6-(phenethylamino)pyrimidin-4-yl]amine Formula: C17H15BrN6O2 MolecularWeight: 415.244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC=NC(=C2[N+](=O)[O-])NC3=NC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN6O2/c18-13-6-7-14(20-10-13)23-17-15(24(25)26)16(21-11-22-17)19-9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H2,19,20,21,22,23)