4-nitro-N-[(3-oxidanylpyridin-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-nitro-N-[(3-oxidanylpyridin-2-yl)carbamothioyl]benzamide Openeye Name: N-[(3-hydroxy-2-pyridyl)carbamothioyl]-4-nitro-benzamide CAS Name: N-[[(3-hydroxy-2-pyridinyl)amino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: N-[(3-hydroxypyridin-2-yl)carbamothioyl]-4-nitrobenzamide Traditional Name: N-[(3-hydroxy-2-pyridyl)thiocarbamoyl]-4-nitro-benzamide Formula: C13H10N4O4S MolecularWeight: 318.3079

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O4S/c18-10-2-1-7-14-11(10)15-13(22)16-12(19)8-3-5-9(6-4-8)17(20)21/h1-7,18H,(H2,14,15,16,19,22)