Vitas-M small molecule compound
2-ethoxy-4-{(E)-[6-oxo-2-(pyridin-3-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}phenyl acetate
Catalog ID
STK817170
SMILES CCOc1cc(ccc1OC(=O)C)/C=c\1/sc2n(c1=O)nc(n2)c1cccnc1
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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 C20H16N4O4S MW 408.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O4S/c1-3-27-16-9-13(6-7-15(16)28-12(2)25)10-17-19(26)24-20(29-17)22-18(23-24)14-5-4-8-21-11-14/h4-11H,3H2,1-2H3/b17-10+InChIKey
ORASXIXJAYBPME-LICLKQGHSA-NSynonyms
(2ETHOXY4((E)(6OXO2PYRIDIN3YL(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)PHENYL)ACETATE
2ethoxy4((E)(6oxo2(pyridin3yl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)phenylacetate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C4=CN=CC=C4)S2)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)nc(n2)c1cccnc1
InChI=1SC20H16N4O4Sc132716913(6715(16)2812(2)25)101719(26)2420(2917)2218(2324)14548211114h411H3H212H3b1710+
MFCD04446277
ZINC000006354938
ZINC06354938
ZINC6354938
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