methyl 2-[(3-chloranyl-2,6-dimethyl-phenyl)-(2-propanoylsulfanylethanoyl)amino]propanoate

Systemtic Name: methyl 2-[(3-chloranyl-2,6-dimethyl-phenyl)-(2-propanoylsulfanylethanoyl)amino]propanoate Openeye Name: methyl 2-(3-chloro-2,6-dimethyl-N-(2-propanoylsulfanylacetyl)anilino)propanoate CAS Name: 2-(3-chloro-2,6-dimethyl-N-[1-oxo-2-(1-oxopropylthio)ethyl]anilino)propanoic acid methyl ester IUPAC Name: methyl 2-(3-chloro-2,6-dimethyl-N-(2-propanoylsulfanylacetyl)anilino)propanoate Traditional Name: 2-(3-chloro-2,6-dimethyl-N-[2-(propionylthio)acetyl]anilino)propionic acid methyl ester Formula: C17H22ClNO4S MolecularWeight: 371.87888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SCC(=O)N(C1=C(C=CC(=C1C)Cl)C)C(C)C(=O)OC

Isomeric SMILES

CCC(=O)SCC(=O)N(C1=C(C=CC(=C1C)Cl)C)C(C)C(=O)OC

InChI

InChI=1S/C17H22ClNO4S/c1-6-15(21)24-9-14(20)19(12(4)17(22)23-5)16-10(2)7-8-13(18)11(16)3/h7-8,12H,6,9H2,1-5H3