Vitas-M small molecule compound
(5Z)-5-({1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK798390
SMILES C=CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1cccnc1)c1ccccc1
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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 C28H20N6O2S MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20N6O2S/c1-2-15-36-23-12-10-19(11-13-23)25-21(18-33(31-25)22-8-4-3-5-9-22)16-24-27(35)34-28(37-24)30-26(32-34)20-7-6-14-29-17-20/h2-14,16-18H,1,15H2/b24-16-InChIKey
JKHQLNMNOMQFKJ-JLPGSUDCSA-NSynonyms
(5Z)5((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)2(pyridin3yl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2PYRIDIN3YL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2(pyridin3yl)thiazolo(32b)(124)triazol6(5H)one
C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CN=CC=C5)S3)C6=CC=CC=C6
C=CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1cccnc1)c1ccccc1
InChI=1SC28H20N6O2Sc12153623121019(111323)2521(1833(3125)228435922)162427(35)3428(3724)3026(3234)207614291720h2141618H115H2b2416
MFCD02992018
ZINC000013801559
ZINC13801559
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