[(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[2-methylpropyl-[[(3Z)-2-oxidanylidene-3-[(pentan-2-ylamino)methylidene]-1H-indol-5-yl]sulfonyl]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-[2-methylpropyl-[[(3Z)-2-oxidanylidene-3-[(pentan-2-ylamino)methylidene]-1H-indol-5-yl]sulfonyl]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-2-hydroxy-3-[isobutyl-[(3Z)-3-[(1-methylbutylamino)methylene]-2-oxo-indolin-5-yl]sulfonyl-amino]propyl]carbamate CAS Name: N-[(2S,3R)-3-hydroxy-4-[2-methylpropyl-[[(3Z)-2-oxo-3-[(pentan-2-ylamino)methylidene]-1H-indol-5-yl]sulfonyl]amino]-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)-3-hydroxy-4-[2-methylpropyl-[[(3Z)-2-oxo-3-[(pentan-2-ylamino)methylidene]-1H-indol-5-yl]sulfonyl]amino]-1-phenylbutan-2-yl]carbamate Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-[isobutyl-[(3Z)-2-keto-3-[(1-methylbutylamino)methylene]indolin-5-yl]sulfonyl-amino]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:

CCCC(C)NC=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

CCCC(C)N/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/c1-5-9-23(4)36-18-28-27-17-25(12-13-29(27)37-33(28)41)48(43,44)39(19-22(2)3)20-31(40)30(16-24-10-7-6-8-11-24)38-35(42)47-32-21-46-34-26(32)14-15-45-34/h6-8,10-13,17-18,22-23,26,30-32,34,36,40H,5,9,14-16,19-21H2,1-4H3,(H,37,41)(H,38,42)/b28-18-/t23?,26-,30-,31+,32-,34+/m0/s1