Vitas-M small molecule compound
3-(6-fluoro-1H-indol-1-yl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)propan-1-one
Catalog ID
STL318803
SMILES Fc1ccc2c(c1)n(CCC(=O)N1CCC3(C(C1)CCCC3)O)cc2
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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 C20H25FN2O2 MW 344.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25FN2O2/c21-17-5-4-15-6-10-22(18(15)13-17)11-7-19(24)23-12-9-20(25)8-2-1-3-16(20)14-23/h4-6,10,13,16,25H,1-3,7-9,11-12,14H2InChIKey
VIUDVFAEWYQYOL-UHFFFAOYSA-NSynonyms
1(4ahydroxy13456788aoctahydroisoquinolin2yl)3(6fluoroindol1yl)propan1one
3(6fluoro1Hindol1yl)1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)propan1one
3(6fluoro1Hindol1yl)1(4ahydroxyoctahydroisoquinolin2(1H)yl)propan1one
C1CCC2(CCN(CC2C1)C(=O)CCN3C=CC4=C3C=C(C=C4)F)O
Fc1ccc2c(c1)n(CCC(=O)N1CC(C@@)3((C@H)(C1)CCCC3)O)cc2
InChI=1SC20H25FN2O2c2117541561022(18(15)1317)11719(24)2312920(25)821316(20)1423h4610131625H1379111214H2
MFCD28031498
ZINC000079501764
ZINC000095479576
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