(2S)-3-methoxysulfanyl-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]butanoic acid

Systemtic Name: (2S)-3-methoxysulfanyl-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]butanoic acid Openeye Name: (2S)-2-[benzyl(tert-butoxycarbonyl)amino]-3-methoxysulfanyl-3-methyl-butanoic acid CAS Name: (2S)-3-(methoxythio)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]butanoic acid IUPAC Name: (2S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-methoxysulfanyl-3-methylbutanoic acid Traditional Name: (2S)-2-[benzyl(tert-butoxycarbonyl)amino]-3-(methoxythio)-3-methyl-butyric acid Formula: C18H27NO5S MolecularWeight: 369.47568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(C(=O)O)C(C)(C)SOC

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)[C@@H](C(=O)O)C(C)(C)SOC

InChI

InChI=1S/C18H27NO5S/c1-17(2,3)24-16(22)19(12-13-10-8-7-9-11-13)14(15(20)21)18(4,5)25-23-6/h7-11,14H,12H2,1-6H3,(H,20,21)/t14-/m0/s1