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

Systemtic Name: 4-methyl-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-methyl-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide CAS Name: 4-methyl-N'-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-methyl-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-methyl-N'-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]benzohydrazide Formula: C22H23N7O3 MolecularWeight: 433.46312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N7O3/c1-16-7-9-17(10-8-16)22(30)26-25-20-19(29(31)32)21(24-15-23-20)28-13-11-27(12-14-28)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3,(H,26,30)(H,23,24,25)