Vitas-M small molecule compound
(5Z)-2-(2,6-dimethylmorpholin-4-yl)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-thiazol-4(5H)-one
Catalog ID
STK798514
SMILES CC1OC(C)CN(C1)C1=NC(=O)/C(=C/c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/S1
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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 C32H29FN4O3S MW 568.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29FN4O3S/c1-21-17-36(18-22(2)40-21)32-34-31(38)29(41-32)16-25-19-37(26-9-4-3-5-10-26)35-30(25)23-12-14-27(15-13-23)39-20-24-8-6-7-11-28(24)33/h3-16,19,21-22H,17-18,20H2,1-2H3/b29-16-InChIKey
OCTYGOFTGQPKGB-MWLSYYOVSA-NSynonyms
(5Z)2(26dimethylmorpholin4yl)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)13thiazol4(5H)one
(5Z)2(26DIMETHYLMORPHOLIN4YL)5((3(4((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)13THIAZOL4ONE
CC1CN(CC(O1)C)C2=NC(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)S2
CC1OC(C)CN(C1)C1=NC(=O)C(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)S1
InChI=1SC32H29FN4O3Sc1211736(1822(2)4021)323431(38)29(4132)16251937(2694351026)3530(25)23121427(151323)3920248671128(24)33h316192122H171820H212H3b2916
MFCD03417718
ZINC000100838914
ZINC000100838922
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