[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-oxidanyl-1-[4-(1,3-thiazol-4-ylmethoxy)phenyl]butan-2-yl]carbamate

Systemtic Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-oxidanyl-1-[4-(1,3-thiazol-4-ylmethoxy)phenyl]butan-2-yl]carbamate Openeye Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(1S,2R)-3-[1,3-benzodioxol-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-1-[[4-(thiazol-4-ylmethoxy)phenyl]methyl]propyl]carbamate CAS Name: N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-[4-(4-thiazolylmethoxy)phenyl]butan-2-yl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester IUPAC Name: [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[1,3-benzodioxol-5-ylsulfonyl(2-methylpropyl)amino]-3-hydroxy-1-[4-(1,3-thiazol-4-ylmethoxy)phenyl]butan-2-yl]carbamate Traditional Name: N-[(1S,2R)-3-[1,3-benzodioxol-5-ylsulfonyl(isobutyl)amino]-2-hydroxy-1-[4-(thiazol-4-ylmethoxy)benzyl]propyl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester Formula: C32H39N3O10S2 MolecularWeight: 689.79616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=C(C=C1)OCC2=CSC=N2)NC(=O)OC3COC4C3CCO4)O)S(=O)(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=C(C=C1)OCC2=CSC=N2)NC(=O)O[C@H]3CO[C@@H]4[C@H]3CCO4)O)S(=O)(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C32H39N3O10S2/c1-20(2)13-35(47(38,39)24-7-8-28-29(12-24)44-19-43-28)14-27(36)26(34-32(37)45-30-16-42-31-25(30)9-10-40-31)11-21-3-5-23(6-4-21)41-15-22-17-46-18-33-22/h3-8,12,17-18,20,25-27,30-31,36H,9-11,13-16,19H2,1-2H3,(H,34,37)/t25-,26-,27+,30-,31+/m0/s1