methyl 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(4,5-dihydrothiazol-2-ylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-(4,5-dihydrothiazol-2-ylthio)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(2-thiazolin-2-ylthio)acetyl]amino]benzoic acid methyl ester Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NCCS2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NCCS2

InChI

InChI=1S/C13H14N2O3S2/c1-18-12(17)9-2-4-10(5-3-9)15-11(16)8-20-13-14-6-7-19-13/h2-5H,6-8H2,1H3,(H,15,16)