N'-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide

Systemtic Name: N'-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-[4-(2,3-dimethylphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-[4-(2,3-dimethylphenyl)piperazino]-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C22H24N8O3 MolecularWeight: 448.47776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NNC(=O)C4=CC=NC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C3=C(C(=NC=N3)NNC(=O)C4=CC=NC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N8O3/c1-15-4-3-5-18(16(15)2)28-10-12-29(13-11-28)21-19(30(32)33)20(24-14-25-21)26-27-22(31)17-6-8-23-9-7-17/h3-9,14H,10-13H2,1-2H3,(H,27,31)(H,24,25,26)