4-chloranyl-2-[(Z)-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylhydrazinylidene]methyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(Z)-[2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoylhydrazinylidene]methyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(Z)-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]hydrazono]methyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(Z)-[[2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1-oxoethyl]hydrazinylidene]methyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(Z)-[[2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetyl]hydrazinylidene]methyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[(Z)-[[2-[(4,6-dimethylpyrimidin-2-yl)thio]acetyl]hydrazono]methyl]-6-nitro-phenolate Formula: C15H13ClN5O4S- MolecularWeight: 394.81282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N/N=C\C2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl)C

InChI

InChI=1S/C15H14ClN5O4S/c1-8-3-9(2)19-15(18-8)26-7-13(22)20-17-6-10-4-11(16)5-12(14(10)23)21(24)25/h3-6,23H,7H2,1-2H3,(H,20,22)/p-1/b17-6-