S-tert-butyl (2R,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-3-phenyl-propanethioate

Systemtic Name: S-tert-butyl (2R,3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-3-phenyl-propanethioate Openeye Name: S-tert-butyl (2R,3R)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenyl-propanethioate CAS Name: (2R,3R)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanethioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl (2R,3R)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanethioate Traditional Name: (2R,3R)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenyl-propanethioic acid S-tert-butyl ester Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C1=CC=CC=C1)[C@H](C(=O)SC(C)(C)C)O

InChI

InChI=1S/C18H27NO4S/c1-17(2,3)23-16(22)19-13(12-10-8-7-9-11-12)14(20)15(21)24-18(4,5)6/h7-11,13-14,20H,1-6H3,(H,19,22)/t13-,14-/m1/s1