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

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

Systemtic Name:2-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)butanoylamino]benzoic acid
Openeye Name:2-[2-(4,5-dihydrothiazol-2-ylsulfanyl)butanoylamino]benzoic acid
CAS Name:2-[[2-(4,5-dihydrothiazol-2-ylthio)-1-oxobutyl]amino]benzoic acid
IUPAC Name:2-[2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)butanoylamino]benzoic acid
Traditional Name:2-[2-(2-thiazolin-2-ylthio)butanoylamino]benzoic acid
Formula: C14H16N2O3S2
MolecularWeight: 324.41844
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)O)SC2=NCCS2


Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)O)SC2=NCCS2


InChI

InChI=1S/C14H16N2O3S2/c1-2-11(21-14-15-7-8-20-14)12(17)16-10-6-4-3-5-9(10)13(18)19/h3-6,11H,2,7-8H2,1H3,(H,16,17)(H,18,19)


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