Vitas-M small molecule compound
(5E)-2-(2,6-dimethylmorpholin-4-yl)-5-[3-methoxy-4-(3-methylbutoxy)benzylidene]-1,3-thiazol-4(5H)-one
Catalog ID
STK702133
SMILES COc1cc(ccc1OCCC(C)C)/C=C\1/SC(=NC1=O)N1CC(C)OC(C1)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 C22H30N2O4S MW 418.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O4S/c1-14(2)8-9-27-18-7-6-17(10-19(18)26-5)11-20-21(25)23-22(29-20)24-12-15(3)28-16(4)13-24/h6-7,10-11,14-16H,8-9,12-13H2,1-5H3/b20-11+InChIKey
DJCRMLYXXYCYKK-RGVLZGJSSA-NSynonyms
(5E)2(26DIMETHYLMORPHOLIN4YL)5((3METHOXY4(3METHYLBUTOXY)PHENYL)METHYLIDENE)13THIAZOL4ONE
(5E)2(26dimethylmorpholin4yl)5(3methoxy4(3methylbutoxy)benzylidene)13thiazol4(5H)one
(E)2(26dimethylmorpholino)5(4(isopentyloxy)3methoxybenzylidene)thiazol4(5H)one
CC1CN(CC(O1)C)C2=NC(=O)C(=CC3=CC(=C(C=C3)OCCC(C)C)OC)S2
COc1cc(ccc1OCCC(C)C)C=C1SC(=NC1=O)N1CC(C)OC(C1)C
InChI=1SC22H30N2O4Sc114(2)8927187617(1019(18)265)112021(25)2322(2920)241215(3)2816(4)1324h6710111416H891213H215H3b2011+
MFCD02985385
ZINC000004837057
ZINC000013785636
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