Vitas-M small molecule compound
(5Z)-2-(4-chlorophenyl)-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK821355
SMILES CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)Cl)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 C28H20ClN5O2S MW 526.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN5O2S/c1-2-36-23-14-10-18(11-15-23)25-20(17-33(31-25)22-6-4-3-5-7-22)16-24-27(35)34-28(37-24)30-26(32-34)19-8-12-21(29)13-9-19/h3-17H,2H2,1H3/b24-16-InChIKey
LKCDVPOUOOPHEL-JLPGSUDCSA-NSynonyms
(5Z)2(4chlorophenyl)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4CHLOROPHENYL)5((3(4ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)Cl)S3)C6=CC=CC=C6
CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)Cl)c1ccccc1
InChI=1SC28H20ClN5O2Sc123623141018(111523)2520(1733(3125)226435722)162427(35)3428(3724)3026(3234)1981221(29)13919h317H2H21H3b2416
MFCD03462730
ZINC000097946926
ZINC97946926
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