(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethylsulfanyl)butanoic acid

Systemtic Name: (2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethylsulfanyl)butanoic acid Openeye Name: (2S)-3-benzylsulfanyl-2-(tert-butoxycarbonylamino)-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(phenylmethylthio)butanoic acid IUPAC Name: (2S)-3-benzylsulfanyl-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid Traditional Name: (2S)-3-(benzylthio)-2-(tert-butoxycarbonylamino)-3-methyl-butyric acid Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](C(=O)O)C(C)(C)SCC1=CC=CC=C1

InChI

InChI=1S/C17H25NO4S/c1-16(2,3)22-15(21)18-13(14(19)20)17(4,5)23-11-12-9-7-6-8-10-12/h6-10,13H,11H2,1-5H3,(H,18,21)(H,19,20)/t13-/m0/s1