2-[[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-(2H-1,3-thiazol-3-yl)amino]ethanoic acid

Systemtic Name: 2-[[2-methyl-3-(phenylcarbonylsulfanyl)propanoyl]-(2H-1,3-thiazol-3-yl)amino]ethanoic acid Openeye Name: 2-[(3-benzoylsulfanyl-2-methyl-propanoyl)-(2H-thiazol-3-yl)amino]acetic acid CAS Name: 2-[[3-(benzoylthio)-2-methyl-1-oxopropyl]-(2H-thiazol-3-yl)amino]acetic acid IUPAC Name: 2-[(3-benzoylsulfanyl-2-methylpropanoyl)-(2H-1,3-thiazol-3-yl)amino]acetic acid Traditional Name: 2-[[3-(benzoylthio)-2-methyl-propanoyl]-(4-thiazolin-3-yl)amino]acetic acid Formula: C16H18N2O4S2 MolecularWeight: 366.45512

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)N(CC(=O)O)N2CSC=C2

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)N(CC(=O)O)N2CSC=C2

InChI

InChI=1S/C16H18N2O4S2/c1-12(10-24-16(22)13-5-3-2-4-6-13)15(21)18(9-14(19)20)17-7-8-23-11-17/h2-8,12H,9-11H2,1H3,(H,19,20)