N'-[6-[2-(4-methylphenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide

Systemtic Name: N'-[6-[2-(4-methylphenyl)carbonylhydrazinyl]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide Openeye Name: N'-[6-[2-(4-methylbenzoyl)hydrazino]-5-nitro-pyrimidin-4-yl]furan-2-carbohydrazide CAS Name: N'-[6-[[(4-methylphenyl)-oxomethyl]hydrazo]-5-nitro-4-pyrimidinyl]-2-furancarbohydrazide IUPAC Name: N'-[6-[2-(4-methylbenzoyl)hydrazinyl]-5-nitropyrimidin-4-yl]furan-2-carbohydrazide Traditional Name: N'-[5-nitro-6-(N'-p-toluoylhydrazino)pyrimidin-4-yl]-2-furohydrazide Formula: C17H15N7O5 MolecularWeight: 397.3449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC2=C(C(=NC=N2)NNC(=O)C3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N7O5/c1-10-4-6-11(7-5-10)16(25)22-20-14-13(24(27)28)15(19-9-18-14)21-23-17(26)12-3-2-8-29-12/h2-9H,1H3,(H,22,25)(H,23,26)(H2,18,19,20,21)