Vitas-M small molecule compound
2-[(5E)-5-(2-butoxybenzylidene)-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Catalog ID
STK812585
SMILES CCCCOc1ccccc1/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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c1-3-4-13-29-18-11-7-5-9-16(18)14-20-22(28)26-23(31-20)24-21(25-26)17-10-6-8-12-19(17)30-15(2)27/h5-12,14H,3-4,13H2,1-2H3/b20-14+InChIKey
NYPUKKPHWGQSOV-XSFVSMFZSA-NSynonyms
616210-28-7(2((5E)5((2BUTOXYPHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
(E)2(5(2butoxybenzylidene)6oxo56dihydrothiazolo(32b)(124)triazol2yl)phenylacetate
2((5E)5(2butoxybenzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
616210287
CCCCOC1=CC=CC=C1C=C2C(=O)N3C(=NC(=N3)C4=CC=CC=C4OC(=O)C)S2
CCCCOc1ccccc1C=c1sc2n(c1=O)nc(n2)c1ccccc1OC(=O)C
InChI=1SC23H21N3O4Sc1341329181175916(18)142022(28)2623(3120)2421(2526)1710681219(17)3015(2)27h51214H3413H212H3b2014+
MFCD03663323
ZINC000002365913
ZINC02365913
ZINC2365913
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