(phenylmethyl) 2-[[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[2-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]ethanoate Openeye Name: benzyl 2-[[2-(thiazol-4-ylmethylsulfanyl)benzoyl]amino]acetate CAS Name: 2-[[oxo-[2-(4-thiazolylmethylthio)phenyl]methyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]amino]acetate Traditional Name: 2-[[2-(thiazol-4-ylmethylthio)benzoyl]amino]acetic acid benzyl ester Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC=CC=C2SCC3=CSC=N3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)C2=CC=CC=C2SCC3=CSC=N3

InChI

InChI=1S/C20H18N2O3S2/c23-19(25-11-15-6-2-1-3-7-15)10-21-20(24)17-8-4-5-9-18(17)27-13-16-12-26-14-22-16/h1-9,12,14H,10-11,13H2,(H,21,24)