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

Systemtic Name: 2-bromanyl-N'-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]-2-bromo-benzohydrazide CAS Name: 2-bromo-N'-[5-nitro-6-[(phenylmethyl)amino]-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(benzylamino)-5-nitropyrimidin-4-yl]-2-bromobenzohydrazide Traditional Name: N'-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]-2-bromo-benzohydrazide Formula: C18H15BrN6O3 MolecularWeight: 443.2541

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

InChI=1S/C18H15BrN6O3/c19-14-9-5-4-8-13(14)18(26)24-23-17-15(25(27)28)16(21-11-22-17)20-10-12-6-2-1-3-7-12/h1-9,11H,10H2,(H,24,26)(H2,20,21,22,23)