Vitas-M small molecule compound
(2Z)-2-(1,3-benzothiazol-2-yl)-3-[3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Catalog ID
STK706807
SMILES COc1cccc(c1)c1nn(cc1/C=C(\c1nc2c(s1)cccc2)/C#N)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 C26H18N4OS MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N4OS/c1-31-22-11-7-8-18(15-22)25-20(17-30(29-25)21-9-3-2-4-10-21)14-19(16-27)26-28-23-12-5-6-13-24(23)32-26/h2-15,17H,1H3/b19-14-InChIKey
ZPRWJBPAPMUOOU-RGEXLXHISA-NSynonyms
1008882-82-3(2Z)2(13benzothiazol2yl)3(3(3methoxyphenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(Z)2(13benzothiazol2yl)3(3(3methoxyphenyl)1phenylpyrazol4yl)prop2enenitrile
(Z)2(benzo(d)thiazol2yl)3(3(3methoxyphenyl)1phenyl1Hpyrazol4yl)acrylonitrile
1008882823
COC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5
COc1cccc(c1)c1nn(cc1C=C(c1nc2c(s1)cccc2)C#N)c1ccccc1
InChI=1SC26H18N4OSc13122117818(1522)2520(1730(2925)2193241021)1419(1627)26282312561324(23)3226h21517H1H3b1914
MFCD04015064
ZINC000009458111
ZINC09458111
ZINC9458111
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