2-[2-(4-cyanophenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-(4-cyanophenoxy)ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-(4-cyanophenoxy)acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(4-cyanophenoxy)-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-(4-cyanophenoxy)acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-(4-cyanophenoxy)acetyl]amino]-4-(methylthio)butyric acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)COC1=CC=C(C=C1)C#N

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)COC1=CC=C(C=C1)C#N

InChI

InChI=1S/C14H16N2O4S/c1-21-7-6-12(14(18)19)16-13(17)9-20-11-4-2-10(8-15)3-5-11/h2-5,12H,6-7,9H2,1H3,(H,16,17)(H,18,19)