Vitas-M small molecule compound
[(4aS,8aS)-4a-hydroxyoctahydroisoquinolin-2(1H)-yl]{2-[(3-methylbutyl)amino]-1,3-thiazol-4-yl}methanone
Catalog ID
STL538927
SMILES CC(CCNc1scc(n1)C(=O)N1CC[C@@]2([C@H](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 C18H29N3O2S MW 351.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29N3O2S/c1-13(2)6-9-19-17-20-15(12-24-17)16(22)21-10-8-18(23)7-4-3-5-14(18)11-21/h12-14,23H,3-11H2,1-2H3,(H,19,20)/t14-,18-/m0/s1InChIKey
UXQXLDLTGCHBDZ-KSSFIOAISA-NSynonyms
1574477-02-3((4~(a)~(S)8~(a)~(S))4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)(2(3methylbutylamino)13thiazol4yl)methanone
((4aS8aS)4ahydroxyoctahydroisoquinolin2(1H)yl)(2((3methylbutyl)amino)13thiazol4yl)methanone
(4ahydroxyoctahydroisoquinolin2(1H)yl)(2(isopentylamino)thiazol4yl)methanone
1574477023
71826944
CC(CCNc1scc(n1)C(=O)N1CCC2(C(C1)CCCC2)O)C
InChI=1SC18H29N3O2Sc113(2)6919172015(122417)16(22)2110818(23)743514(18)1121h121423H311H212H3(H1920)t1418m0s1
ZINC000096114408
ZINC96114408
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