N-[(methyl-oxidanylidene-phenyl-$l^{6}-sulfanylidene)carbamothioyl]-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxamide

Systemtic Name: N-[(methyl-oxidanylidene-phenyl-$l^{6}-sulfanylidene)carbamothioyl]-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-carboxamide Openeye Name: N-[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)carbamothioyl]-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide CAS Name: N-[[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)amino]-sulfanylidenemethyl]-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide IUPAC Name: N-[(methyl-oxo-phenyl-$l^{6}-sulfanylidene)carbamothioyl]-1-oxido-2,1,3-benzoxadiazol-1-ium-5-carboxamide Traditional Name: N-[(keto-methyl-phenyl-persulfuranylidene)thiocarbamoyl]-1-oxido-benzofurazan-1-ium-5-carboxamide Formula: C15H12N4O4S2 MolecularWeight: 376.41018

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Descriptors Computed from Structure

Canonical SMILES:

CS(=NC(=S)NC(=O)C1=CC2=NO[N+](=C2C=C1)[O-])(=O)C3=CC=CC=C3

Isomeric SMILES

C[S@](=NC(=S)NC(=O)C1=CC2=NO[N+](=C2C=C1)[O-])(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H12N4O4S2/c1-25(22,11-5-3-2-4-6-11)18-15(24)16-14(20)10-7-8-13-12(9-10)17-23-19(13)21/h2-9H,1H3,(H,16,20,24)/t25-/m0/s1