4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(4,5-dihydrothiazol-2-ylsulfanyl)acetyl]amino]benzoic acid CAS Name: 4-[[2-(4,5-dihydrothiazol-2-ylthio)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(2-thiazolin-2-ylthio)acetyl]amino]benzoic acid Formula: C12H12N2O3S2 MolecularWeight: 296.36528

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CSC(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H12N2O3S2/c15-10(7-19-12-13-5-6-18-12)14-9-3-1-8(2-4-9)11(16)17/h1-4H,5-7H2,(H,14,15)(H,16,17)