(2R)-2-azanyl-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]sulfanyl-propanoic acid

Systemtic Name: (2R)-2-azanyl-3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]sulfanyl-propanoic acid Openeye Name: (2R)-2-amino-3-[3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]sulfanyl-propanoic acid CAS Name: (2R)-2-amino-3-[[2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-phenylbutyl]thio]propanoic acid IUPAC Name: (2R)-2-amino-3-[2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbutyl]sulfanylpropanoic acid Traditional Name: (2R)-2-amino-3-[[3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butyl]thio]propionic acid Formula: C18H28N2O5S MolecularWeight: 384.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(CSCC(C(=O)O)N)O

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5S/c1-18(2,3)25-17(24)20-14(9-12-7-5-4-6-8-12)15(21)11-26-10-13(19)16(22)23/h4-8,13-15,21H,9-11,19H2,1-3H3,(H,20,24)(H,22,23)/t13-,14?,15?/m0/s1