(2S)-6-[[(2S,3R)-3-benzyloxy-2-(tert-butoxycarbonylamino)butanoyl]amino]-2-[isobutyl(p-tolylsulfonyl)amino]hexanoic acid (HCID 5495869)

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Basic information

Standard SMILES: Cc1ccc(S(=O)(=O)N(CC(C)C)[C@@H](CCCCNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc2ccccc2)C(=O)O)cc1
InChIKey: OWFXHIDYEYICMR-IGBKUBFESA-N
Molecular formula: C33H49N3O8S
Average molar mass: 647.8 g/mol
Monoisotopic mass: 647.3240367

Names & identifiers

Preferred name: (2S)-6-[[(2S,3R)-3-benzyloxy-2-(tert-butoxycarbonylamino)butanoyl]amino]-2-[isobutyl(p-tolylsulfonyl)amino]hexanoic acid
IUPAC: (2S)-2-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-6-[[(2S,3R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylmethoxybutanoyl]amino]hexanoic acid

Names & synonyms

OWFXHIDYEYICMR-IGBKUBFESA-N(2S)-6-[[(2S,3R)-3-benzyloxy-2-(tert-butoxycarbonylamino)butanoyl]amino]-2-[isobutyl(p-tolylsulfonyl)amino]hexanoic acidN.alpha.-isobutyl-N.alpha.-(4-methylbenzenesulfonyl)-N.epsilon.-(N'.alpha.-tert-butoxycarbonyl-O-benzyl-L-threonyl)-L-lysineNalpha-isobutyl-Nalpha-(4-methylbenzenesulfonyl)-Nepsilon-(N'alpha-tert-butoxycarbonyl-O-benzyl-L-threonyl)-L-lysine