methyl (3S)-3-[[(2S)-2-[[(2S)-2-[6-[5-[(3aS,5S,6aR)-2-oxidanylidene-1,3,3a,5,6,6a-hexahydrothieno[2,3-d]imidazol-5-yl]pentanoylamino]hexanoylamino]-3-methyl-butanoyl]amino]propanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoate

Systemtic Name: methyl (3S)-3-[[(2S)-2-[[(2S)-2-[6-[5-[(3aS,5S,6aR)-2-oxidanylidene-1,3,3a,5,6,6a-hexahydrothieno[2,3-d]imidazol-5-yl]pentanoylamino]hexanoylamino]-3-methyl-butanoyl]amino]propanoyl]amino]-5-fluoranyl-4-oxidanylidene-pentanoate Openeye Name: methyl (3S)-3-[[(2S)-2-[[(2S)-2-[6-[5-[(3aS,5S,6aR)-2-oxo-1,3,3a,5,6,6a-hexahydrothieno[2,3-d]imidazol-5-yl]pentanoylamino]hexanoylamino]-3-methyl-butanoyl]amino]propanoyl]amino]-5-fluoro-4-oxo-pentanoate CAS Name: (3S)-3-[[(2S)-2-[[(2S)-2-[[6-[[5-[(3aS,5S,6aR)-2-oxo-1,3,3a,5,6,6a-hexahydrothieno[2,3-d]imidazol-5-yl]-1-oxopentyl]amino]-1-oxohexyl]amino]-3-methyl-1-oxobutyl]amino]-1-oxopropyl]amino]-5-fluoro-4-oxopentanoic acid methyl ester IUPAC Name: methyl (3S)-3-[[(2S)-2-[[(2S)-2-[6-[5-[(3aS,5S,6aR)-2-oxo-1,3,3a,5,6,6a-hexahydrothieno[2,3-d]imidazol-5-yl]pentanoylamino]hexanoylamino]-3-methylbutanoyl]amino]propanoyl]amino]-5-fluoro-4-oxopentanoate Traditional Name: (3S)-3-[[(2S)-2-[[(2S)-2-[6-[5-[(3aS,5S,6aR)-2-keto-1,3,3a,5,6,6a-hexahydrothien[2,3-d]imidazol-5-yl]pentanoylamino]hexanoylamino]-3-methyl-butanoyl]amino]propanoyl]amino]-5-fluoro-4-keto-valeric acid methyl ester Formula: C30H49FN6O8S MolecularWeight: 672.808863

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C)C(=O)NC(CC(=O)OC)C(=O)CF)NC(=O)CCCCCNC(=O)CCCCC1CC2C(S1)NC(=O)N2

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(=O)OC)C(=O)CF)NC(=O)[C@H](C(C)C)NC(=O)CCCCCNC(=O)CCCC[C@H]1C[C@@H]2[C@H](S1)NC(=O)N2

InChI

InChI=1S/C30H49FN6O8S/c1-17(2)26(28(43)33-18(3)27(42)34-20(22(38)16-31)15-25(41)45-4)36-24(40)12-6-5-9-13-32-23(39)11-8-7-10-19-14-21-29(46-19)37-30(44)35-21/h17-21,26,29H,5-16H2,1-4H3,(H,32,39)(H,33,43)(H,34,42)(H,36,40)(H2,35,37,44)/t18-,19-,20-,21+,26-,29-/m0/s1