methyl 2-benzamido-3-methylsulfanyl-butanoate

Systemtic Name: methyl 2-benzamido-3-methylsulfanyl-butanoate Openeye Name: methyl 2-benzamido-3-methylsulfanyl-butanoate CAS Name: 2-benzamido-3-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-methylsulfanylbutanoate Traditional Name: 2-benzamido-3-(methylthio)butyric acid methyl ester Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)C1=CC=CC=C1)SC

Isomeric SMILES

CC(C(C(=O)OC)NC(=O)C1=CC=CC=C1)SC

InChI

InChI=1S/C13H17NO3S/c1-9(18-3)11(13(16)17-2)14-12(15)10-7-5-4-6-8-10/h4-9,11H,1-3H3,(H,14,15)