N'-[6-(butylamino)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide

Systemtic Name: N'-[6-(butylamino)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-(butylamino)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-(butylamino)-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-(butylamino)-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-(butylamino)-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C14H17N7O3 MolecularWeight: 331.32988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC=NC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C(=NC=N1)NNC(=O)C2=CC=NC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N7O3/c1-2-3-6-16-12-11(21(23)24)13(18-9-17-12)19-20-14(22)10-4-7-15-8-5-10/h4-5,7-9H,2-3,6H2,1H3,(H,20,22)(H2,16,17,18,19)