ethyl 4-methylsulfanyl-2-[2-(2,4,6-trimethylphenyl)ethanoylamino]butanoate

Systemtic Name: ethyl 4-methylsulfanyl-2-[2-(2,4,6-trimethylphenyl)ethanoylamino]butanoate Openeye Name: ethyl 4-methylsulfanyl-2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]butanoate CAS Name: 4-(methylthio)-2-[[1-oxo-2-(2,4,6-trimethylphenyl)ethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-methylsulfanyl-2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]butanoate Traditional Name: 2-[(2-mesitylacetyl)amino]-4-(methylthio)butyric acid ethyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)CC1=C(C=C(C=C1C)C)C

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)CC1=C(C=C(C=C1C)C)C

InChI

InChI=1S/C18H27NO3S/c1-6-22-18(21)16(7-8-23-5)19-17(20)11-15-13(3)9-12(2)10-14(15)4/h9-10,16H,6-8,11H2,1-5H3,(H,19,20)