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

Systemtic Name: N'-[6-[(3-methylphenyl)amino]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-(3-methylanilino)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-(3-methylanilino)-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-(3-methylanilino)-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-(m-toluidino)-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C17H15N7O3 MolecularWeight: 365.3461

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N7O3/c1-11-3-2-4-13(9-11)21-15-14(24(26)27)16(20-10-19-15)22-23-17(25)12-5-7-18-8-6-12/h2-10H,1H3,(H,23,25)(H2,19,20,21,22)