N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide

Systemtic Name: N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide Openeye Name: N'-[5-nitro-6-[2-(p-tolylsulfonyl)hydrazino]pyrimidin-4-yl]-2-phenyl-acetohydrazide CAS Name: N'-[6-[(4-methylphenyl)sulfonylhydrazo]-5-nitro-4-pyrimidinyl]-2-phenylacetohydrazide IUPAC Name: N'-[6-[2-(4-methylphenyl)sulfonylhydrazinyl]-5-nitropyrimidin-4-yl]-2-phenylacetohydrazide Traditional Name: N'-[5-nitro-6-(N'-tosylhydrazino)pyrimidin-4-yl]-2-phenyl-acetohydrazide Formula: C19H19N7O5S MolecularWeight: 457.46306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H19N7O5S/c1-13-7-9-15(10-8-13)32(30,31)25-24-19-17(26(28)29)18(20-12-21-19)23-22-16(27)11-14-5-3-2-4-6-14/h2-10,12,25H,11H2,1H3,(H,22,27)(H2,20,21,23,24)