methyl (2R)-2-[2-(3,5-dimethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[2-(3,5-dimethylphenoxy)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-(3,5-dimethylphenoxy)acetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC(CCSC)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N[C@H](CCSC)C(=O)OC)C

InChI

InChI=1S/C16H23NO4S/c1-11-7-12(2)9-13(8-11)21-10-15(18)17-14(5-6-22-4)16(19)20-3/h7-9,14H,5-6,10H2,1-4H3,(H,17,18)/t14-/m1/s1