Vitas-M small molecule compound
(5E)-2-(4-butoxyphenyl)-5-(2-propoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK810888
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C/c1ccccc1OCCC)/c2=O
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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 C24H25N3O3S MW 435.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O3S/c1-3-5-15-29-19-12-10-17(11-13-19)22-25-24-27(26-22)23(28)21(31-24)16-18-8-6-7-9-20(18)30-14-4-2/h6-13,16H,3-5,14-15H2,1-2H3/b21-16+InChIKey
GJOIPVBDQICRMS-LTGZKZEYSA-NSynonyms
(5E)2(4butoxyphenyl)5((2propoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5E)2(4butoxyphenyl)5(2propoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=CC=C4OCCC)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccccc1OCCC)c2=O
InChI=1SC24H25N3O3Sc135152919121017(111319)22252427(2622)23(28)21(3124)1618867920(18)301442h61316H351415H212H3b2116+
MFCD03933056
ZINC000016701311
ZINC16701311
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