4-nitro-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenolate

Systemtic Name: 4-nitro-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenolate Openeye Name: 4-nitro-2-[[(E)-3-(2-thienyl)prop-2-enoyl]carbamothioylamino]phenolate CAS Name: 4-nitro-2-[[[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 4-nitro-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]carbamothioylamino]phenolate Traditional Name: 4-nitro-2-[[(E)-3-(2-thienyl)acryloyl]thiocarbamoylamino]phenolate Formula: C14H10N3O4S2- MolecularWeight: 348.3769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O4S2/c18-12-5-3-9(17(20)21)8-11(12)15-14(22)16-13(19)6-4-10-2-1-7-23-10/h1-8,18H,(H2,15,16,19,22)/p-1/b6-4+