[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[[(3Z)-3-[[ethyl(propyl)amino]methylidene]-2-oxidanylidene-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-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-[[(3Z)-3-[[ethyl(propyl)amino]methylidene]-2-oxidanylidene-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-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)-1-benzyl-3-[[(3Z)-3-[[ethyl(propyl)amino]methylene]-2-oxo-indolin-5-yl]sulfonyl-isobutyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[[(3Z)-3-[[ethyl(propyl)amino]methylidene]-2-oxo-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-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-[[(3Z)-3-[[ethyl(propyl)amino]methylidene]-2-oxo-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-3-[[(3Z)-3-[[ethyl(propyl)amino]methylene]-2-keto-indolin-5-yl]sulfonyl-isobutyl-amino]-2-hydroxy-propyl]carbamic acid [(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester Formula: C35H48N4O8S MolecularWeight: 684.84262

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC)C=C1C2=C(C=CC(=C2)S(=O)(=O)N(CC(C)C)CC(C(CC3=CC=CC=C3)NC(=O)OC4COC5C4CCO5)O)NC1=O

Isomeric SMILES

CCCN(CC)/C=C\1/C2=C(C=CC(=C2)S(=O)(=O)N(C[C@H]([C@H](CC3=CC=CC=C3)NC(=O)O[C@H]4CO[C@@H]5[C@H]4CCO5)O)CC(C)C)NC1=O

InChI

InChI=1S/C35H48N4O8S/c1-5-15-38(6-2)20-28-27-18-25(12-13-29(27)36-33(28)41)48(43,44)39(19-23(3)4)21-31(40)30(17-24-10-8-7-9-11-24)37-35(42)47-32-22-46-34-26(32)14-16-45-34/h7-13,18,20,23,26,30-32,34,40H,5-6,14-17,19,21-22H2,1-4H3,(H,36,41)(H,37,42)/b28-20-/t26-,30-,31+,32-,34+/m0/s1