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

Systemtic Name: 4-nitro-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-nitro-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide CAS Name: 4-nitro-N'-[5-nitro-6-(1-phenylethylamino)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-nitro-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-nitro-N'-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]benzohydrazide Formula: C19H17N7O5 MolecularWeight: 423.38218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N7O5/c1-12(13-5-3-2-4-6-13)22-17-16(26(30)31)18(21-11-20-17)23-24-19(27)14-7-9-15(10-8-14)25(28)29/h2-12H,1H3,(H,24,27)(H2,20,21,22,23)