Vitas-M small molecule compound
2-{(5Z)-5-[3-(acetyloxy)benzylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
Catalog ID
STK818779
SMILES CC(=O)Oc1cccc(c1)/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1OC(=O)C
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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 C21H15N3O5S MW 421.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5S/c1-12(25)28-15-7-5-6-14(10-15)11-18-20(27)24-21(30-18)22-19(23-24)16-8-3-4-9-17(16)29-13(2)26/h3-11H,1-2H3/b18-11-InChIKey
YGLLOEDJSUQSNU-WQRHYEAKSA-NSynonyms
(3((Z)(2(2ACETYLOXYPHENYL)6OXO(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
2((5Z)5(3(acetyloxy)benzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
CC(=O)OC1=CC=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4OC(=O)C)S2
CC(=O)Oc1cccc(c1)C=c1sc2n(c1=O)nc(n2)c1ccccc1OC(=O)C
InChI=1SC21H15N3O5Sc112(25)281575614(1015)111820(27)2421(3018)2219(2324)16834917(16)2913(2)26h311H12H3b1811
MFCD03533092
ZINC000016737007
ZINC16737007
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