methyl 2-(2,2-dimethylpropanoylamino)-2-(phenylmethylsulfanyl)ethanoate

Systemtic Name: methyl 2-(2,2-dimethylpropanoylamino)-2-(phenylmethylsulfanyl)ethanoate Openeye Name: methyl 2-benzylsulfanyl-2-(2,2-dimethylpropanoylamino)acetate CAS Name: 2-[(2,2-dimethyl-1-oxopropyl)amino]-2-(phenylmethylthio)acetic acid methyl ester IUPAC Name: methyl 2-benzylsulfanyl-2-(2,2-dimethylpropanoylamino)acetate Traditional Name: 2-(benzylthio)-2-(pivaloylamino)acetic acid methyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(C(=O)OC)SCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)C(=O)NC(C(=O)OC)SCC1=CC=CC=C1

InChI

InChI=1S/C15H21NO3S/c1-15(2,3)14(18)16-12(13(17)19-4)20-10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,16,18)