2-bromanyl-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 2-bromanyl-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 2-bromo-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 2-bromo-N'-[5-nitro-6-(1-phenylethylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 2-bromo-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 2-bromo-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Formula: C19H17BrN6O3 MolecularWeight: 457.28068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3Br)[N+](=O)[O-]

InChI

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