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

Systemtic Name: [(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[[3-[[methyl(propan-2-ylsulfonyl)amino]methyl]-1,2-benzoxazol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: [(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-[[3-[[isopropylsulfonyl(methyl)amino]methyl]-1,2-benzoxazol-5-yl]sulfonyl]amino]propyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-4-[[3-[[methyl(propan-2-ylsulfonyl)amino]methyl]-1,2-benzoxazol-5-yl]sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]carbamic acid [(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester IUPAC Name: [(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-3-hydroxy-4-[[3-[[methyl(propan-2-ylsulfonyl)amino]methyl]-1,2-benzoxazol-5-yl]sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-[3-[[isopropylsulfonyl(methyl)amino]methyl]indoxazen-5-yl]sulfonyl-amino]propyl]carbamic acid [(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester Formula: C33H46N4O10S2 MolecularWeight: 722.86914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)C4=CC5=C(C=C4)ON=C5CN(C)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)CN(C[C@H]([C@H](CC1=CC=CC=C1)NC(=O)OC2CO[C@@H]3[C@H]2CCO3)O)S(=O)(=O)C4=CC5=C(C=C4)ON=C5CN(C)S(=O)(=O)C(C)C

InChI

InChI=1S/C33H46N4O10S2/c1-21(2)17-37(49(42,43)24-11-12-30-26(16-24)28(35-47-30)18-36(5)48(40,41)22(3)4)19-29(38)27(15-23-9-7-6-8-10-23)34-33(39)46-31-20-45-32-25(31)13-14-44-32/h6-12,16,21-22,25,27,29,31-32,38H,13-15,17-20H2,1-5H3,(H,34,39)/t25-,27-,29+,31?,32+/m0/s1