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

Systemtic Name: 2-bromanyl-N'-[6-[methyl-(phenylmethyl)amino]-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-[benzyl(methyl)amino]-5-nitro-pyrimidin-4-yl]-2-bromo-benzohydrazide CAS Name: 2-bromo-N'-[6-[methyl-(phenylmethyl)amino]-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-[benzyl(methyl)amino]-5-nitropyrimidin-4-yl]-2-bromobenzohydrazide Traditional Name: N'-[6-[benzyl(methyl)amino]-5-nitro-pyrimidin-4-yl]-2-bromo-benzohydrazide Formula: C19H17BrN6O3 MolecularWeight: 457.28068

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NNC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C19H17BrN6O3/c1-25(11-13-7-3-2-4-8-13)18-16(26(28)29)17(21-12-22-18)23-24-19(27)14-9-5-6-10-15(14)20/h2-10,12H,11H2,1H3,(H,24,27)(H,21,22,23)