Elunonavir

Catalog No. :: ACUCXD651
CAS No. :: 2242428-57-3
Molecular Formula :: C52H59F10N11O8
Molecular Weight :: 1156.09

IUPAC Name:methyl ((5S,8S,9S,14S)-11-(4-(1-(difluoromethyl)-1H-pyrazol-3-yl)-2,6-difluorobenzyl)-16,16,16-trifluoro-9-hydroxy-15,15-dimethyl-8-(4-((2-(8-(oxetan-3-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl)pyrimidin-5-yl)ethynyl)benzyl)-3,6,13-trioxo-5-(1,1,1-trifluoro-2-methylpropan-2-yl)-2-oxa-4,7,11,12-tetraazahexadecan-14-yl)carbamate

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Product Information

Product Name	Elunonavir
IUPAC Name	methyl ((5S,8S,9S,14S)-11-(4-(1-(difluoromethyl)-1H-pyrazol-3-yl)-2,6-difluorobenzyl)-16,16,16-trifluoro-9-hydroxy-15,15-dimethyl-8-(4-((2-(8-(oxetan-3-yl)-3,8-diazabicyclo[3.2.1]octan-3-yl)pyrimidin-5-yl)ethynyl)benzyl)-3,6,13-trioxo-5-(1,1,1-trifluoro-2-methylpropan-2-yl)-2-oxa-4,7,11,12-tetraazahexadecan-14-yl)carbamate
Molecular Formula	C52H59F10N11O8
Molecular Weight	1156.09
SMILES	COC(=O)N[C@H](C(=O)N[C@@H](CC1=CC=C(C#CC2=CN=C(N3CC4CCC(C3)N4C3COC3)N=C2)C=C1)[C@@H](O)CN(CC1=C(F)C=C(C2=NN(C(F)F)C=C2)C=C1F)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C(F)(F)F)C(C)(C)C(F)(F)F
InChI Key	ZTSLYWLHCOINNI-FTEFBJIISA-N
Synonym	2,5,6,10,13-Pentaazatetradecanedioic acid, 6-[[4-[1-(difluoromethyl)-1H-pyrazol-3-yl]-2,6-difluorophenyl]methyl]-8-hydroxy-9-[[4-[2-[2-[8-(3-oxetanyl)-3,8-diazabicyclo[3.2.1]oct-3-yl]-5-pyrimidinyl]ethynyl]phenyl]methyl]-4,11-dioxo-3,12-bis(2,2,2-trifluoro-1,1-dimethylethyl)-, 1,14-dimethyl ester, (3S,8S,9S,12S)-;2,5,6,10,13-Pentaazatetradecanedioic acid, 6-[[4-[1-(difluoromethyl)-1H-pyrazol-3-yl]-2,6-difluorophenyl]methyl]-8-hydroxy-9-[[4-[2-[2-[8-(3-oxetanyl)-3,8-diazabicyclo[3.2.1]oct-3-yl]-5-pyrimidinyl]ethynyl]phenyl]methyl]-4,11-dioxo-3,12-bis(2,2,2-trifluoro-1,1-dimethylethyl)-, 1,14-dimethyl ester, (...;Elunonavir;GS-1156(Elunonavir);GS-1156;GS-PI1
CAS No.	2242428-57-3
PubChem CID	135301900

Synthetic Route by SureRoute

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ACUCXD6512242428-57-3

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Elunonavir

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Synthetic Route by SureRoute

1. ACUCXD651 Molecular Building Block Synthetic Route

2. ACUCXD651 Molecular Building Block Synthetic Route

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Elunonavir

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Synthetic Route by SureRoute

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