methyl 3-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-ethanoylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-acetylsulfanyl-2-(tert-butoxycarbonylamino)-3-phenyl-propanoate CAS Name: 3-(acetylthio)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-acetylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate Traditional Name: 3-(acetylthio)-2-(tert-butoxycarbonylamino)-3-phenyl-propionic acid methyl ester Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO5S/c1-11(19)24-14(12-9-7-6-8-10-12)13(15(20)22-5)18-16(21)23-17(2,3)4/h6-10,13-14H,1-5H3,(H,18,21)