Vitas-M small molecule compound
2-[(5Z)-5-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Catalog ID
STK876805
SMILES CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)C)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 C29H21N5O3S MW 519.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21N5O3S/c1-18-12-14-20(15-13-18)26-21(17-33(31-26)22-8-4-3-5-9-22)16-25-28(36)34-29(38-25)30-27(32-34)23-10-6-7-11-24(23)37-19(2)35/h3-17H,1-2H3/b25-16-InChIKey
WLZMVLKNBIFOPL-XYGWBWBKSA-NSynonyms
384367-28-6(2((5Z)5((3(4METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
(Z)2(6oxo5((1phenyl3(ptolyl)1Hpyrazol4yl)methylene)56dihydrothiazolo(32b)(124)triazol2yl)phenylacetate
2((5Z)5((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
384367286
CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1)s2
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5OC(=O)C)S3)C6=CC=CC=C6
InChI=1SC29H21N5O3Sc118121420(151318)2621(1733(3126)228435922)162528(36)3429(3825)3027(3234)2310671124(23)3719(2)35h317H12H3b2516
MFCD03017199
ZINC000001258854
ZINC01258854
ZINC1258854
Check stock
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Check stock on Vitas-MAvailable files
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