N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide

Systemtic Name: N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-[(2-methyl-5-quinolyl)amino]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[6-[(2-methyl-5-quinolinyl)amino]-5-nitro-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-[(2-methylquinolin-5-yl)amino]-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-[(2-methyl-5-quinolyl)amino]-5-nitro-pyrimidin-4-yl]nicotinohydrazide Formula: C20H16N8O3 MolecularWeight: 416.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)NNC(=O)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)NNC(=O)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N8O3/c1-12-7-8-14-15(24-12)5-2-6-16(14)25-18-17(28(30)31)19(23-11-22-18)26-27-20(29)13-4-3-9-21-10-13/h2-11H,1H3,(H,27,29)(H2,22,23,25,26)