Vitas-M small molecule compound

(5Z)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one

Catalog ID
STK897503
SMILES COc1ccc(cc1)c1nn2c(n1)s/c(=C\c1cn(nc1c1ccc(cc1)F)c1ccccc1)/c2=O

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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/c1-35-22-13-9-18(10-14-22)25-29-27-33(31-25)26(34)23(36-27)15-19-16-32(21-5-3-2-4-6-21)30-24(19)17-7-11-20(28)12-8-17/h2-16H,1H3/b23-15-
InChIKey
MMGPCHMQGSTEHB-HAHDFKILSA-N
Synonyms

(5Z)5((3(4fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)2(4methoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
5((3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)METHYLENE)2(4METHOXYPHENYL)13THIAZOLIDINO(32D)124TRIAZOL6ONE
COC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)F)C6=CC=CC=C6)SC3=N2
COc1ccc(cc1)c1nn2c(n1)sc(=Cc1cn(nc1c1ccc(cc1)F)c1ccccc1)c2=O
InChI=1SC27H18FN5O2Sc1352213918(101422)25292733(3125)26(34)23(3627)15191632(215324621)3024(19)1771120(28)12817h216H1H3b2315
MFCD03497661
ZINC000001806419
ZINC01806419
ZINC1806419

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Available files

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