Vitas-M small molecule compound
2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)ethanone
Catalog ID
STL242980
SMILES O=C(N1CCC2(C(C1)CCCC2)O)Cc1csc(n1)c1ccccc1Cl
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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 C20H23ClN2O2S MW 390.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O2S/c21-17-7-2-1-6-16(17)19-22-15(13-26-19)11-18(24)23-10-9-20(25)8-4-3-5-14(20)12-23/h1-2,6-7,13-14,25H,3-5,8-12H2InChIKey
HKKOHKIBUNIMIX-UHFFFAOYSA-NSynonyms
1(4ahydroxy13456788aoctahydroisoquinolin2yl)2(2(2chlorophenyl)13thiazol4yl)ethanone
2(2(2chlorophenyl)13thiazol4yl)1(4ahydroxyoctahydroisoquinolin2(1H)yl)ethanone
2(2(2chlorophenyl)thiazol4yl)1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)ethanone
C1CCC2(CCN(CC2C1)C(=O)CC3=CSC(=N3)C4=CC=CC=C4Cl)O
InChI=1SC20H23ClN2O2Sc2117721616(17)192215(132619)1118(24)2310920(25)843514(20)1223h1267131425H35812H2
MFCD24859476
O=C(N1CC(C@@)2((C@H)(C1)CCCC2)O)Cc1csc(n1)c1ccccc1Cl
ZINC000072405843
ZINC000095482700
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