Vitas-M small molecule compound
2-[(5Z)-5-(3-nitrobenzylidene)-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Catalog ID
STK794358
SMILES CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)/c(=C/c1cccc(c1)[N+](=O)[O-])/s2
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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 C19H12N4O5S MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12N4O5S/c1-11(24)28-15-8-3-2-7-14(15)17-20-19-22(21-17)18(25)16(29-19)10-12-5-4-6-13(9-12)23(26)27/h2-10H,1H3/b16-10-InChIKey
HBCHRIVLIAUGPA-YBEGLDIGSA-NSynonyms
329219-72-9(2((5Z)5((3NITROPHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
(Z)2(5(3nitrobenzylidene)6oxo56dihydrothiazolo(32b)(124)triazol2yl)phenylacetate
2((5Z)5(3nitrobenzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
329219729
CC(=O)OC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC(=CC=C4)(N+)(=O)(O))SC3=N2
CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)c(=Cc1cccc(c1)(N+)(=O)(O))s2
InChI=1SC19H12N4O5Sc111(24)2815832714(15)17201922(2117)18(25)16(2919)101254613(912)23(26)27h210H1H3b1610
MFCD03289747
ZINC000001087563
ZINC01087563
ZINC1087563
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