Vitas-M small molecule compound
(3a'S,6a'R)-5'-tert-butyl-5-fluoro-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STK590676
SMILES CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(F)cc1
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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 C20H24FN3O3S MW 405.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24FN3O3S/c1-19(2,3)24-16(25)14-13(7-8-28-4)23-20(15(14)17(24)26)11-9-10(21)5-6-12(11)22-18(20)27/h5-6,9,13-15,23H,7-8H2,1-4H3,(H,22,27)/t13?,14-,15+,20?/m1/s1InChIKey
KZZWSFLSIRDUQY-LTWWHTJUSA-NSynonyms
1212458-64-4(3aR6aS)5tertbutyl5fluoro1(2methylsulfanylethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(tertbutyl)5fluoro3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5tertbutyl5fluoro3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212458644
CC(C)(C)N1C(=O)C2C(NC3(C2C1=O)C4=C(C=CC(=C4)F)NC3=O)CCSC
CSCCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(F)cc1
InChI=1SC20H24FN3O3Sc119(23)2416(25)1413(78284)2320(15(14)17(24)26)11910(21)5612(11)2218(20)27h569131523H78H214H3(H2227)t13?1415+20?m1s1
MFCD06788343
ZINC000016022253
ZINC000016022256
Check stock
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Check stock on Vitas-MAvailable files
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