N'-[6-(butan-2-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[6-(butan-2-ylamino)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(butan-2-ylamino)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(butan-2-ylamino)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[5-nitro-6-(sec-butylamino)pyrimidin-4-yl]benzohydrazide Formula: C15H18N6O3 MolecularWeight: 330.34182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=NC=N1)NNC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C(=NC=N1)NNC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O3/c1-3-10(2)18-13-12(21(23)24)14(17-9-16-13)19-20-15(22)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,20,22)(H2,16,17,18,19)