Vitas-M small molecule compound
(5Z)-2-(4-methoxyphenyl)-5-{[3-(3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK813004
SMILES COc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1cccc(c1)[N+](=O)[O-])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 C27H18N6O4S MW 522.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N6O4S/c1-37-22-12-10-17(11-13-22)25-28-27-32(30-25)26(34)23(38-27)15-19-16-31(20-7-3-2-4-8-20)29-24(19)18-6-5-9-21(14-18)33(35)36/h2-16H,1H3/b23-15-InChIKey
DUWFLHDSBXOCOD-HAHDFKILSA-NSynonyms
623935-02-4(5Z)2(4methoxyphenyl)5((3(3nitrophenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4METHOXYPHENYL)5((3(3NITROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
2(4METHOXYPHENYL)5((3(3NITROPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)THIAZOLO(32B)(124)TRIAZOL6(5H)ONE
623935024
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=CC=C5)(N+)(=O)(O))C6=CC=CC=C6)SC3=N2
COc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1cccc(c1)(N+)(=O)(O))c1ccccc1)c2=O
InChI=1SC27H18N6O4Sc13722121017(111322)25282732(3025)26(34)23(3827)15191631(207324820)2924(19)1865921(1418)33(35)36h216H1H3b2315
MFCD03534464
ZINC000100847630
ZINC100847630
Check stock
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Check stock on Vitas-MAvailable files
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