Vitas-M small molecule compound

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

Catalog ID
STK800572
SMILES COc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)F)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 C28H20FN5O2S MW 509.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20FN5O2S/c1-17-14-19(10-13-23(17)36-2)25-20(16-33(31-25)22-6-4-3-5-7-22)15-24-27(35)34-28(37-24)30-26(32-34)18-8-11-21(29)12-9-18/h3-16H,1-2H3/b24-15-
InChIKey
PRWIRKCDAAXSSE-IWIPYMOSSA-N
Synonyms
957032-14-3
(5Z)2(4fluorophenyl)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2(4FLUOROPHENYL)5((3(4METHOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4fluorophenyl)5((3(4methoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)thiazolo(32b)(124)triazol6(5H)one
957032143
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)F)S3)C6=CC=CC=C6)OC
COc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)F)c1ccccc1
InChI=1SC28H20FN5O2Sc1171419(101323(17)362)2520(1633(3125)226435722)152427(35)3428(3724)3026(3234)1881121(29)12918h316H12H3b2415
MFCD04017198
ZINC000013513501
ZINC13513501

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Available files

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