methyl 2-methyl-2-[[3-(methylsulfanylmethyl)-1-benzofuran-2-yl]carbonylamino]propanoate

Systemtic Name: methyl 2-methyl-2-[[3-(methylsulfanylmethyl)-1-benzofuran-2-yl]carbonylamino]propanoate Openeye Name: methyl 2-methyl-2-[[3-(methylsulfanylmethyl)benzofuran-2-carbonyl]amino]propanoate CAS Name: 2-methyl-2-[[[3-[(methylthio)methyl]-2-benzofuranyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[3-(methylsulfanylmethyl)-1-benzofuran-2-carbonyl]amino]propanoate Traditional Name: 2-methyl-2-[[3-[(methylthio)methyl]benzofuran-2-carbonyl]amino]propionic acid methyl ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)C1=C(C2=CC=CC=C2O1)CSC

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)C1=C(C2=CC=CC=C2O1)CSC

InChI

InChI=1S/C16H19NO4S/c1-16(2,15(19)20-3)17-14(18)13-11(9-22-4)10-7-5-6-8-12(10)21-13/h5-8H,9H2,1-4H3,(H,17,18)