methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethylsulfanyl)ethanoate

Systemtic Name: methyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethylsulfanyl)ethanoate Openeye Name: methyl 2-benzylsulfanyl-2-(tert-butoxycarbonylamino)acetate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(phenylmethylthio)acetic acid methyl ester IUPAC Name: methyl 2-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate Traditional Name: 2-(benzylthio)-2-(tert-butoxycarbonylamino)acetic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4S/c1-15(2,3)20-14(18)16-12(13(17)19-4)21-10-11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,16,18)