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

Systemtic Name: N'-[6-[(2,4-dimethylphenyl)amino]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-(2,4-dimethylanilino)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-(2,4-dimethylanilino)-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-(2,4-dimethylanilino)-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-(2,4-dimethylanilino)-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C18H17N7O3 MolecularWeight: 379.37268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H17N7O3/c1-11-3-4-14(12(2)9-11)22-16-15(25(27)28)17(21-10-20-16)23-24-18(26)13-5-7-19-8-6-13/h3-10H,1-2H3,(H,24,26)(H2,20,21,22,23)