Vitas-M small molecule compound
(5Z)-5-{[3-(3-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK799982
SMILES COc1ccc(cc1F)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1)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 C27H18FN5O2S MW 495.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18FN5O2S/c1-35-22-13-12-18(14-21(22)28)24-19(16-32(30-24)20-10-6-3-7-11-20)15-23-26(34)33-27(36-23)29-25(31-33)17-8-4-2-5-9-17/h2-16H,1H3/b23-15-InChIKey
ZRIAYCUDZZCTKO-HAHDFKILSA-NSynonyms
(5Z)5((3(3fluoro4methoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2phenyl(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(3fluoro4methoxyphenyl)1phenylpyrazol4yl)methylidene)2phenyl(13)thiazolo(32b)(124)triazol6one
COC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5)S3)C6=CC=CC=C6)F
COc1ccc(cc1F)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccccc1)c1ccccc1
InChI=1SC27H18FN5O2Sc13522131218(1421(22)28)2419(1632(3024)20106371120)152326(34)3327(3623)2925(3133)178425917h216H1H3b2315
MFCD03534562
ZINC000016735334
ZINC16735334
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