Vitas-M small molecule compound
(5Z)-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK897502
SMILES COc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1ccccc1)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 C27H19N5O2S MW 477.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O2S/c1-34-22-14-12-19(13-15-22)25-28-27-32(30-25)26(33)23(35-27)16-20-17-31(21-10-6-3-7-11-21)29-24(20)18-8-4-2-5-9-18/h2-17H,1H3/b23-16-InChIKey
OWWQSJJTWQOENK-KQWNVCNZSA-NSynonyms
(5Z)5((13diphenyl1Hpyrazol4yl)methylidene)2(4methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((13DIPHENYLPYRAZOL4YL)METHYLIDENE)2(4METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6)SC3=N2
COc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1ccccc1)c1ccccc1)c2=O
InChI=1SC27H19N5O2Sc13422141219(131522)25282732(3025)26(33)23(3527)16201731(21106371121)2924(20)188425918h217H1H3b2316
MFCD03497657
ZINC000001806410
ZINC01806410
ZINC1806410
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