Vitas-M small molecule compound
(5Z)-5-({3-[4-(hexyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-(morpholin-4-yl)-1,3-thiazol-4(5H)-one
Catalog ID
STK799330
SMILES CCCCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCOCC1)c1ccccc1
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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 C29H32N4O3S MW 516.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O3S/c1-2-3-4-8-17-36-25-13-11-22(12-14-25)27-23(21-33(31-27)24-9-6-5-7-10-24)20-26-28(34)30-29(37-26)32-15-18-35-19-16-32/h5-7,9-14,20-21H,2-4,8,15-19H2,1H3/b26-20-InChIKey
WNQDFFMPHLWASE-QOMWVZHYSA-NSynonyms
(5Z)5((3(4(hexyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(morpholin4yl)13thiazol4(5H)one
(5Z)5((3(4HEXOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2MORPHOLIN4YL13THIAZOL4ONE
CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5
CCCCCCOc1ccc(cc1)c1nn(cc1C=C1SC(=NC1=O)N1CCOCC1)c1ccccc1
InChI=1SC29H32N4O3Sc12348173625131122(121425)2723(2133(3127)2496571024)202628(34)3029(3726)32151835191632h579142021H2481519H21H3b2620
MFCD03418533
ZINC000016700889
ZINC16700889
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