[(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[[(3Z)-3-[1-(butylamino)ethylidene]-2-oxidanylidene-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate

Systemtic Name: [(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[[(3Z)-3-[1-(butylamino)ethylidene]-2-oxidanylidene-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamate Openeye Name: [(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(1S,2R)-1-benzyl-3-[[(3Z)-3-[1-(butylamino)ethylidene]-2-oxo-indolin-5-yl]sulfonyl-isobutyl-amino]-2-hydroxy-propyl]carbamate CAS Name: N-[(2S,3R)-4-[[(3Z)-3-[1-(butylamino)ethylidene]-2-oxo-1H-indol-5-yl]sulfonyl-(2-methylpropyl)amino]-3-hydroxy-1-phenylbutan-2-yl]carbamic acid [(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] ester IUPAC Name: [(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] N-[(2S,3R)-4-[[(3Z)-3-[1-(butylamino)ethylidene]-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-[1-(butylamino)ethylidene]-2-keto-indolin-5-yl]sulfonyl-isobutyl-amino]-2-hydroxy-propyl]carbamic acid [(4R)-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:

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

Isomeric SMILES

CCCCN/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]4COC5C4CCO5)O)CC(C)C)NC1=O)/C

InChI

InChI=1S/C35H48N4O8S/c1-5-6-15-36-23(4)32-27-18-25(12-13-28(27)37-33(32)41)48(43,44)39(19-22(2)3)20-30(40)29(17-24-10-8-7-9-11-24)38-35(42)47-31-21-46-34-26(31)14-16-45-34/h7-13,18,22,26,29-31,34,36,40H,5-6,14-17,19-21H2,1-4H3,(H,37,41)(H,38,42)/b32-23-/t26?,29-,30+,31-,34?/m0/s1