N'-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]naphthalene-1-carbohydrazide

Systemtic Name: N'-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]naphthalene-1-carbohydrazide Openeye Name: N'-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide CAS Name: N'-[5-nitro-6-[(phenylmethyl)amino]-4-pyrimidinyl]-1-naphthalenecarbohydrazide IUPAC Name: N'-[6-(benzylamino)-5-nitropyrimidin-4-yl]naphthalene-1-carbohydrazide Traditional Name: N'-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]naphthalene-1-carbohydrazide Formula: C22H18N6O3 MolecularWeight: 414.41672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(=O)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C22H18N6O3/c29-22(18-12-6-10-16-9-4-5-11-17(16)18)27-26-21-19(28(30)31)20(24-14-25-21)23-13-15-7-2-1-3-8-15/h1-12,14H,13H2,(H,27,29)(H2,23,24,25,26)