Vitas-M small molecule compound
(5Z)-2-(4-ethoxyphenyl)-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK880576
SMILES CCOc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1ccc(cc1)C)c1ccccc1)/c2=O
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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 C29H23N5O2S MW 505.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O2S/c1-3-36-24-15-13-21(14-16-24)27-30-29-34(32-27)28(35)25(37-29)17-22-18-33(23-7-5-4-6-8-23)31-26(22)20-11-9-19(2)10-12-20/h4-18H,3H2,1-2H3/b25-17-InChIKey
AAGDJNGEEFSXJX-UQQQWYQISA-NSynonyms
623935-43-3(5Z)2(4ethoxyphenyl)5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4ETHOXYPHENYL)5((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
2(4ETHOXYPHENYL)5((1PHENYL3(PTOLYL)1HPYRAZOL4YL)METHYLENE)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
623935433
CCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)C)C6=CC=CC=C6)SC3=N2
CCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1)c2=O
InChI=1SC29H23N5O2Sc133624151321(141624)27302934(3227)28(35)25(3729)17221833(237546823)3126(22)2011919(2)101220h418H3H212H3b2517
MFCD03497654
ZINC000016729586
ZINC16729586
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.