Vitas-M small molecule compound
(5Z)-5-({3-[4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-(morpholin-4-yl)-1,3-thiazol-4(5H)-one
Catalog ID
STK811686
SMILES CC(COc1ccc(cc1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCOCC1)c1ccccc1)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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-19(2)18-34-23-10-8-20(9-11-23)25-21(17-31(29-25)22-6-4-3-5-7-22)16-24-26(32)28-27(35-24)30-12-14-33-15-13-30/h3-11,16-17,19H,12-15,18H2,1-2H3/b24-16-InChIKey
YBPMQJBWUJCIPL-JLPGSUDCSA-NSynonyms
(5Z)5((3(4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(morpholin4yl)13thiazol4(5H)one
(5Z)5((3(4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2MORPHOLIN4YL13THIAZOL4ONE
CC(C)COC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5
CC(COc1ccc(cc1)c1nn(cc1C=C1SC(=NC1=O)N1CCOCC1)c1ccccc1)C
InChI=1SC27H28N4O3Sc119(2)18342310820(91123)2521(1731(2925)226435722)162426(32)2827(3524)30121433151330h311161719H121518H212H3b2416
MFCD06264922
ZINC000016713739
ZINC16713739
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