4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-6-nitro-benzene-1,3-diolate

Systemtic Name: 4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-6-nitro-benzene-1,3-diolate Openeye Name: 4-[(E)-(methylcarbamothioylhydrazono)methyl]-6-nitro-benzene-1,3-diolate CAS Name: 4-[(E)-[[methylamino(sulfanylidene)methyl]hydrazinylidene]methyl]-6-nitrobenzene-1,3-diolate IUPAC Name: 4-[(E)-(methylcarbamothioylhydrazinylidene)methyl]-6-nitrobenzene-1,3-diolate Traditional Name: 4-[(E)-(methylthiocarbamoylhydrazono)methyl]-6-nitro-benzene-1,3-diolate Formula: C9H8N4O4S-2 MolecularWeight: 268.24922

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC(=C(C=C1[O-])[O-])[N+](=O)[O-]

Isomeric SMILES

CNC(=S)N/N=C/C1=CC(=C(C=C1[O-])[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H10N4O4S/c1-10-9(18)12-11-4-5-2-6(13(16)17)8(15)3-7(5)14/h2-4,14-15H,1H3,(H2,10,12,18)/p-2/b11-4+