2-bromanyl-N'-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[6-(ethylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[6-(ethylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[6-(ethylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C13H13BrN6O3 MolecularWeight: 381.18472

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C(=NC=N1)NNC(=O)C2=CC=CC=C2Br)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C(=NC=N1)NNC(=O)C2=CC=CC=C2Br)[N+](=O)[O-]

InChI

InChI=1S/C13H13BrN6O3/c1-2-15-11-10(20(22)23)12(17-7-16-11)18-19-13(21)8-5-3-4-6-9(8)14/h3-7H,2H2,1H3,(H,19,21)(H2,15,16,17,18)