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AG009CDB

1350514-68-9 | MK5172

Chemical structure of MK5172, CAS 1350514-68-9
AG009CDB
sdsSDS
sdsCOA
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CAS Number 1350514-68-9
Catalog Number AG009CDB(AGN-PC-0WBNZU)
Chemical Name MK5172
IUPAC Name (1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carboxamide
InChI InChI=1S/C38H50N6O9S/c1-6-22-19-38(22,35(47)43-54(49,50)25-13-14-25)42-32(45)29-18-24-20-44(29)34(46)31(37(2,3)4)41-36(48)53-30-16-21(30)10-8-7-9-11-27-33(52-24)40-28-17-23(51-5)12-15-26(28)39-27/h6,12,15,17,21-22,24-25,29-31H,1,7-11,13-14,16,18-20H2,2-5H3,(H,41,48)(H,42,45)(H,43,47)/t21-,22-,24-,29+,30-,31-,38-/m1/s1
InChI Key OBMNJSNZOWALQB-NCQNOWPTSA-N
MDL Number MFCD25976700
Molecular Formula C38H50N6O9S
Molecular Weight 766.9034
SMILES O=C([C@H]1N(C([C@@H](N2)C(C)(C)C)=O)C[C@@](OC3=NC4=CC(OC)=CC=C4N=C3CCCCC[C@H]5[C@@H](C5)OC2=O)([H])C1)N[C@]6([C@H](C=C)C6)C(NS(=O)(C7CC7)=O)=O
UNII 8YE81R1X1J
Synonyms
grazoprevir, grazoprevir anhydrous, grazoprevir monohydrate, MK 5172, MK-5172, MK5172, Grazoprevir, 1350514-68-9, MK5172, UNII-8YE81R1X1J, MK 5172, 8YE81R1X1J, (1aR,5S,8S,10R,22aR)-5-tert-butyl-N-{(1R,2S)-1-[(cyclopropanesulfonyl)carbamoyl]-2-ethenylcyclopropyl}-14-methoxy-3,6-dioxo-1,1a,3,4,5,6,9,10,18,19,20,21,22,22a-tetradecahydro-8H-7,10-methanocyclopropa[18,19][1,10,3,6]dioxadiazacyclononadecino[11,12-b]quinoxaline-8-carboxamide, Grazoprevir [INN], Grazoprevir anhydrous, MK-5172; Grazoprevir, SCHEMBL2175313, CHEMBL2063090, DTXSID50159234, CHEBI:132975, OBMNJSNZOWALQB-NCQNOWPTSA-N, EX-A2253, ZINC95551509, AKOS030253227, CS-1374, DB11575, SB16740, AC-29227, BC600762, HY-15298, SC-94334, W-6087, (1aR,5S,8S,10R,22aR)-5-tert-butyl-N-((1R,2S)-1-{[(cyclopropylsulfonyl)amino]carbonyl}-2-vinylcyclopropyl)-14-methoxy-3,6-dioxo-1,1a,3,4,5,6,9,10,18,19,20,21,22,22a-tetradecahydro-8H-7,10-methanocyclopropa[18,19][1,10,3,6]dioxadiazacyclononadecino[11,12-b]quinoxaline-8-carboxamide, (1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-[(cyclopropanesulfonyl)carbamoyl]-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetraazapentacyclo[24.2.1.0?,??.0?,??.0??,??]nonacosa-3,5,7,9,11-pentaene-27-carboxamide, MK-5172, Grazoprevir hydrate, (1ar,5s,8s,10r,22ar)-5-Tert-Butyl-N-{(1r,2s)-1-[(Cyclopropylsulfonyl)carbamoyl]-2-Ethenylcyclopropyl}-14-Methoxy-3,6-Dioxo-1,1a,3,4,5,6,9,10,18,19,20,21,22,22a-Tetradecahydro-8h-7,10-Methanocyclopropa[18,19][1,10,3,6]dioxadiazacyclononadecino[11,12-B]quinoxaline-8-Carboxamide, SUE, tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-vinyl-cyclopropyl]-methoxy-dioxo-[?]carboxamide,

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    CERTIFICATE OF ANALYSIS
    Chemical Name: Batch Number:
    Chemical Structure: CAS Registry No:
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    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
    Date:
    Reviewed by:Jessie
    Date:
    Angene International Limited