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3-[(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohex[2]en]-3'-yl]-3-[4-(methylsulfanyl)phenyl]-N-{3-(methylsulfanyl)-1-[3-(pyridin-2-yl)-1,2,4-oxadiazol-5-yl]propyl}propanamide

Catalog ID
STL552225
SMILES CSCCC(c1onc(n1)c1ccccn1)NC(=O)CC(C1=C(O)[C@]2([C@@H](CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)c1ccc(cc1)SC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C37H37ClN4O8S2 MW 765.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H37ClN4O8S2/c1-19-16-25(43)29(33(45)37(19)34(46)30-26(47-2)18-27(48-3)31(38)32(30)49-37)22(20-9-11-21(52-5)12-10-20)17-28(44)40-24(13-15-51-4)36-41-35(42-50-36)23-8-6-7-14-39-23/h6-12,14,18-19,22,24,45H,13,15-17H2,1-5H3,(H,40,44)/t19-,22?,24?,
InChIKey
QAYYVKWMIJLBQY-ZZEHZVGZSA-N
Synonyms

135640497
3((1S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(benzofuran21cyclohex(2)en)3yl)N(3(methylthio)1(3(pyridin2yl)124oxadiazol5yl)propyl)3(4(methylthio)phenyl)propanamide
3((2~(S)4~(R))7chloro2hydroxy46dimethoxy4methyl36dioxospiro(1benzofuran23cyclohexene)1yl)3(4methylsulfanylphenyl)~(N)(3methylsulfanyl1(3pyridin2yl124oxadiazol5yl)propyl)propanamide
3((2S6R)7CHLORO2HYDROXY46DIMETHOXY6METHYL34DIOXO3HSPIRO(1BENZOFURAN21CYCLOHEX(2)EN)3YL)3(4(METHYLSULFANYL)PHENYL)N(3(METHYLSULFANYL)1(3(PYRIDIN2YL)124OXADIAZ
3((2S6R)7chloro2hydroxy46dimethoxy6methyl34dioxo3Hspiro(1benzofuran21cyclohex(2)en)3yl)3(4(methylsulfanyl)phenyl)N(3(methylsulfanyl)1(3(pyridin2yl)124oxadiazol5yl)propyl)propanamide
CSCCC(c1onc(n1)c1ccccn1)NC(=O)CC(C1=C(O)(C@)2((C@@H)(CC1=O)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC)c1ccc(cc1)SC
InChI=1SC37H37ClN4O8S2c1191625(43)29(33(45)37(19)34(46)3026(472)1827(483)31(38)32(30)4937)22(2091121(525)121020)1728(44)4024(1315514)364135(425036)23867143923h612141819222445H131517H215H3(H4044)t1922?24?37+m1s1
OL5YL)PROPYL)PROPANAMIDE
ZINC001547138694
ZINC001547138699

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Available files

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