N'-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide

Systemtic Name: N'-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Openeye Name: N'-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide CAS Name: N'-[6-(3,5-dimethyl-1-pyrazolyl)-5-nitro-4-pyrimidinyl]-4-methylbenzenesulfonohydrazide IUPAC Name: N'-[6-(3,5-dimethylpyrazol-1-yl)-5-nitropyrimidin-4-yl]-4-methylbenzenesulfonohydrazide Traditional Name: N'-[6-(3,5-dimethylpyrazol-1-yl)-5-nitro-pyrimidin-4-yl]-4-methyl-benzenesulfonohydrazide Formula: C16H17N7O4S MolecularWeight: 403.41568

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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-])N3C(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])N3C(=CC(=N3)C)C

InChI

InChI=1S/C16H17N7O4S/c1-10-4-6-13(7-5-10)28(26,27)21-19-15-14(23(24)25)16(18-9-17-15)22-12(3)8-11(2)20-22/h4-9,21H,1-3H3,(H,17,18,19)