4-methyl-N'-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]benzenesulfonohydrazide

Systemtic Name: 4-methyl-N'-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]benzenesulfonohydrazide Openeye Name: 4-methyl-N'-[5-nitro-6-(2-phenylhydrazino)pyrimidin-4-yl]benzenesulfonohydrazide CAS Name: 4-methyl-N'-[5-nitro-6-(phenylhydrazo)-4-pyrimidinyl]benzenesulfonohydrazide IUPAC Name: 4-methyl-N'-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]benzenesulfonohydrazide Traditional Name: 4-methyl-N'-[5-nitro-6-(N'-phenylhydrazino)pyrimidin-4-yl]benzenesulfonohydrazide Formula: C17H17N7O4S MolecularWeight: 415.42638

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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-])NNC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NNC3=CC=CC=C3

InChI

InChI=1S/C17H17N7O4S/c1-12-7-9-14(10-8-12)29(27,28)23-22-17-15(24(25)26)16(18-11-19-17)21-20-13-5-3-2-4-6-13/h2-11,20,23H,1H3,(H2,18,19,21,22)