Vitas-M small molecule compound
(2Z)-2-{[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK815459
SMILES Cc1cc(C)c(c(c1)C)c1nn(cc1/C=c/1\sc2n(c1=O)c1c(n2)cccc1)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 C28H22N4OS MW 462.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4OS/c1-17-13-18(2)25(19(3)14-17)26-20(16-31(30-26)21-9-5-4-6-10-21)15-24-27(33)32-23-12-8-7-11-22(23)29-28(32)34-24/h4-16H,1-3H3/b24-15-InChIKey
AEPBNKDVVJJSRD-IWIPYMOSSA-NSynonyms
(2Z)2((1phenyl3(246trimethylphenyl)1Hpyrazol4yl)methylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((1PHENYL3(246TRIMETHYLPHENYL)PYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
CC1=CC(=C(C(=C1)C)C2=NN(C=C2C=C3C(=O)N4C5=CC=CC=C5N=C4S3)C6=CC=CC=C6)C
Cc1cc(C)c(c(c1)C)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cccc1)c1ccccc1
InChI=1SC28H22N4OSc1171318(2)25(19(3)1417)2620(1631(3026)2195461021)152427(33)322312871122(23)2928(32)3424h416H13H3b2415
MFCD03463548
ZINC000016732591
ZINC16732591
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