(1-azanyl-1-oxidanylidene-propan-2-yl) 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-(thiazol-4-ylmethylsulfanyl)benzoate CAS Name: 2-(4-thiazolylmethylthio)benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-(1,3-thiazol-4-ylmethylsulfanyl)benzoate Traditional Name: 2-(thiazol-4-ylmethylthio)benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC=CC=C1SCC2=CSC=N2

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC=CC=C1SCC2=CSC=N2

InChI

InChI=1S/C14H14N2O3S2/c1-9(13(15)17)19-14(18)11-4-2-3-5-12(11)21-7-10-6-20-8-16-10/h2-6,8-9H,7H2,1H3,(H2,15,17)