Vitas-M small molecule compound
(5Z)-5-[(3-{3-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(morpholin-4-yl)-1,3-thiazol-4(5H)-one
Catalog ID
STK558717
SMILES O=C1N=C(S/C/1=C\c1cn(nc1c1cccc(c1)OCc1ccccc1Cl)c1ccccc1)N1CCOCC1
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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 C30H25ClN4O3S MW 557.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN4O3S/c31-26-12-5-4-7-22(26)20-38-25-11-6-8-21(17-25)28-23(19-35(33-28)24-9-2-1-3-10-24)18-27-29(36)32-30(39-27)34-13-15-37-16-14-34/h1-12,17-19H,13-16,20H2/b27-18-InChIKey
APOLLJCNPUHGPE-IMRQLAEWSA-NSynonyms
(5Z)5((3(3((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2(morpholin4yl)13thiazol4(5H)one
(5Z)5((3(3((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2MORPHOLIN4YL13THIAZOL4ONE
(Z)5((3(3((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2morpholinothiazol4(5H)one
C1COCCN1C2=NC(=O)C(=CC3=CN(N=C3C4=CC(=CC=C4)OCC5=CC=CC=C5Cl)C6=CC=CC=C6)S2
InChI=1SC30H25ClN4O3Sc31261254722(26)203825116821(1725)2823(1935(3328)2492131024)182729(36)3230(3927)34131537161434h1121719H131620H2b2718
MFCD04034163
O=C1N=C(SC1=Cc1cn(nc1c1cccc(c1)OCc1ccccc1Cl)c1ccccc1)N1CCOCC1
ZINC000097947613
ZINC000102481914
ZINC97947613
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