4-nitro-2-(thiophen-2-ylcarbonylcarbamothioylamino)phenolate

Systemtic Name: 4-nitro-2-(thiophen-2-ylcarbonylcarbamothioylamino)phenolate Openeye Name: 4-nitro-2-(thiophene-2-carbonylcarbamothioylamino)phenolate CAS Name: 4-nitro-2-[[[[oxo(thiophen-2-yl)methyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 4-nitro-2-(thiophene-2-carbonylcarbamothioylamino)phenolate Traditional Name: 4-nitro-2-(2-thenoylthiocarbamoylamino)phenolate Formula: C12H8N3O4S2- MolecularWeight: 322.33962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O4S2/c16-9-4-3-7(15(18)19)6-8(9)13-12(20)14-11(17)10-2-1-5-21-10/h1-6,16H,(H2,13,14,17,20)/p-1