methyl (2S)-2-[[[(2R,3R)-3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamothioyl]amino]-3-[tert-butyl(dimethyl)silyl]oxy-propanoate

Systemtic Name: methyl (2S)-2-[[[(2R,3R)-3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamothioyl]amino]-3-[tert-butyl(dimethyl)silyl]oxy-propanoate Openeye Name: methyl (2S)-2-[[(tert-butoxycarbonylamino)-[(1R,2R)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]carbamothioyl]amino]-3-[tert-butyl(dimethyl)silyl]oxy-propanoate CAS Name: (2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[[[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]amino]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-[(2-methylpropan-2-yl)oxycarbonylamino]carbamothioyl]amino]propanoate Traditional Name: (2S)-2-[[(tert-butoxycarbonylamino)-[(1R,2R)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]thiocarbamoyl]amino]-3-[tert-butyl(dimethyl)silyl]oxy-propionic acid methyl ester Formula: C28H44F2N6O6SSi MolecularWeight: 658.832866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N(C(=S)NC(CO[Si](C)(C)C(C)(C)C)C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N(C(=S)N[C@@H](CO[Si](C)(C)C(C)(C)C)C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H44F2N6O6SSi/c1-18(28(39,15-35-17-31-16-32-35)20-12-11-19(29)13-21(20)30)36(34-25(38)42-26(2,3)4)24(43)33-22(23(37)40-8)14-41-44(9,10)27(5,6)7/h11-13,16-18,22,39H,14-15H2,1-10H3,(H,33,43)(H,34,38)/t18-,22+,28-/m1/s1