Vitas-M small molecule compound
(5Z)-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK820753
SMILES Cc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccccc1)c1ccccc1)/s2
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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 C27H19N5OS MW 461.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5OS/c1-18-12-14-20(15-13-18)25-28-27-32(30-25)26(33)23(34-27)16-21-17-31(22-10-6-3-7-11-22)29-24(21)19-8-4-2-5-9-19/h2-17H,1H3/b23-16-InChIKey
BEMDHQPIWSHLHS-KQWNVCNZSA-NSynonyms
313049-91-1(5Z)5((13diphenyl1Hpyrazol4yl)methylidene)2(4methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((13DIPHENYLPYRAZOL4YL)METHYLIDENE)2(4METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((13diphenyl1Hpyrazol4yl)methylene)2(ptolyl)thiazolo(32b)(124)triazol6(5H)one
313049911
CC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6)SC3=N2
Cc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1ccccc1)c1ccccc1)s2
InChI=1SC27H19N5OSc118121420(151318)25282732(3025)26(33)23(3427)16211731(22106371122)2924(21)198425919h217H1H3b2316
MFCD01953061
ZINC000002286254
ZINC02286254
ZINC2286254
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