Vitas-M small molecule compound
1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]ethanone
Catalog ID
STL314343
SMILES Cc1cccc(c1)c1scc(n1)CC(=O)N1CCC2(C(C1)CCCC2)O
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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 C21H26N2O2S MW 370.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O2S/c1-15-5-4-6-16(11-15)20-22-18(14-26-20)12-19(24)23-10-9-21(25)8-3-2-7-17(21)13-23/h4-6,11,14,17,25H,2-3,7-10,12-13H2,1H3InChIKey
JAXPNMAEBZEIIY-UHFFFAOYSA-NSynonyms
1((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)2(2(mtolyl)thiazol4yl)ethanone
1(4ahydroxy13456788aoctahydroisoquinolin2yl)2(2(3methylphenyl)13thiazol4yl)ethanone
1(4ahydroxyoctahydroisoquinolin2(1H)yl)2(2(3methylphenyl)13thiazol4yl)ethanone
CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)N3CCC4(CCCCC4C3)O
Cc1cccc(c1)c1scc(n1)CC(=O)N1CC(C@@)2((C@H)(C1)CCCC2)O
InChI=1SC21H26N2O2Sc11554616(1115)202218(142620)1219(24)2310921(25)832717(21)1323h4611141725H237101213H21H3
MFCD28030641
ZINC000079491456
ZINC000095476242
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