methyl 2-[[2-phenylsulfanylethanoyl(propan-2-yl)amino]methyl]-1,3-oxazole-4-carboxylate

Systemtic Name: methyl 2-[[2-phenylsulfanylethanoyl(propan-2-yl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[isopropyl-(2-phenylsulfanylacetyl)amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[1-oxo-2-(phenylthio)ethyl]-propan-2-ylamino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(2-phenylsulfanylacetyl)-propan-2-ylamino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[isopropyl-[2-(phenylthio)acetyl]amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CO1)C(=O)OC)C(=O)CSC2=CC=CC=C2

Isomeric SMILES

CC(C)N(CC1=NC(=CO1)C(=O)OC)C(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O4S/c1-12(2)19(9-15-18-14(10-23-15)17(21)22-3)16(20)11-24-13-7-5-4-6-8-13/h4-8,10,12H,9,11H2,1-3H3