Vitas-M small molecule compound
(5Z)-5-{[3-(1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823938
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)/C1=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 C23H16N4OS3 MW 460.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4OS3/c1-2-12-26-22(28)19(31-23(26)29)13-15-14-27(16-8-4-3-5-9-16)25-20(15)21-24-17-10-6-7-11-18(17)30-21/h2-11,13-14H,1,12H2/b19-13-InChIKey
YHQHRACCWXSTJL-UYRXBGFRSA-NSynonyms
(5Z)5((3(13benzothiazol2yl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(13benzothiazol2yl)1phenylpyrazol4yl)methylidene)3prop2enyl2sulfanylidene13thiazolidin4one
C=CCN1C(=O)C(=CC2=CN(N=C2C3=NC4=CC=CC=C4S3)C5=CC=CC=C5)SC1=S
C=CCN1C(=S)SC(=Cc2cn(nc2c2nc3c(s2)cccc3)c2ccccc2)C1=O
InChI=1SC23H16N4OS3c12122622(28)19(3123(26)29)13151427(168435916)2520(15)21241710671118(17)3021h2111314H112H2b1913
MFCD18075779
ZINC000026779482
ZINC26779482
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