2-oxidanyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzoic acid

Systemtic Name: 2-oxidanyl-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzoic acid Openeye Name: 2-hydroxy-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzoic acid CAS Name: 2-hydroxy-4-[[[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-4-[[(E)-3-phenylprop-2-enoyl]carbamothioylamino]benzoic acid Traditional Name: 2-hydroxy-4-[[(E)-3-phenylacryloyl]thiocarbamoylamino]benzoic acid Formula: C17H14N2O4S MolecularWeight: 342.36906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C17H14N2O4S/c20-14-10-12(7-8-13(14)16(22)23)18-17(24)19-15(21)9-6-11-4-2-1-3-5-11/h1-10,20H,(H,22,23)(H2,18,19,21,24)/b9-6+