Vitas-M small molecule compound
[2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-yl](4a-hydroxyoctahydroisoquinolin-2(1H)-yl)methanone
Catalog ID
STL248996
SMILES Fc1ccc(cc1)c1nc(c(s1)C(=O)N1CCC2(C(C1)CCCC2)O)C
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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 C20H23FN2O2S MW 374.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23FN2O2S/c1-13-17(26-18(22-13)14-5-7-16(21)8-6-14)19(24)23-11-10-20(25)9-3-2-4-15(20)12-23/h5-8,15,25H,2-4,9-12H2,1H3InChIKey
ICWMCNOEYYKCHE-UHFFFAOYSA-NSynonyms
(2(4fluorophenyl)4methyl13thiazol5yl)(4ahydroxyoctahydroisoquinolin2(1H)yl)methanone
(2(4fluorophenyl)4methylthiazol5yl)((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)methanone
(4ahydroxy13456788aoctahydroisoquinolin2yl)(2(4fluorophenyl)4methyl13thiazol5yl)methanone
CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)N3CCC4(CCCCC4C3)O
Fc1ccc(cc1)c1nc(c(s1)C(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O)C
InChI=1SC20H23FN2O2Sc11317(2618(2213)145716(21)8614)19(24)23111020(25)932415(20)1223h581525H24912H21H3
MFCD24861388
ZINC000072405037
ZINC000080332691
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