N-oxidanyl-4-(pyridin-2-ylcarbamothioylamino)benzeneamine oxide

Systemtic Name: N-oxidanyl-4-(pyridin-2-ylcarbamothioylamino)benzeneamine oxide Openeye Name: N-hydroxy-4-(2-pyridylcarbamothioylamino)benzeneamine oxide CAS Name: N-hydroxy-4-[[(2-pyridinylamino)-sulfanylidenemethyl]amino]benzeneamine oxide IUPAC Name: N-hydroxy-4-(pyridin-2-ylcarbamothioylamino)benzeneamine oxide Traditional Name: N-hydroxy-4-(2-pyridylthiocarbamoylamino)benzeneamine oxide Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=S)NC2=CC=C(C=C2)[NH+](O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)NC(=S)NC2=CC=C(C=C2)[NH+](O)[O-]

InChI

InChI=1S/C12H12N4O2S/c17-16(18)10-6-4-9(5-7-10)14-12(19)15-11-3-1-2-8-13-11/h1-8,16-17H,(H2,13,14,15,19)