Vitas-M small molecule compound
(5E)-5-(4-butoxy-3-methoxybenzylidene)-2-(2,4-dichlorophenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703321
SMILES CCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)c1ccc(cc1Cl)Cl
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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 C22H19Cl2N3O3S MW 476.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2N3O3S/c1-3-4-9-30-17-8-5-13(10-18(17)29-2)11-19-21(28)27-22(31-19)25-20(26-27)15-7-6-14(23)12-16(15)24/h5-8,10-12H,3-4,9H2,1-2H3/b19-11+InChIKey
CWAUPILACBZTOE-YBFXNURJSA-NSynonyms
(5E)5((4BUTOXY3METHOXYPHENYL)METHYLIDENE)2(24DICHLOROPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(4butoxy3methoxybenzylidene)2(24dichlorophenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(4butoxy3methoxybenzylidene)2(24dichlorophenyl)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=C(C=C(C=C4)Cl)Cl)S2)OC
CCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1Cl)Cl
InChI=1SC22H19Cl2N3O3Sc134930178513(1018(17)292)111921(28)2722(3119)2520(2627)157614(23)1216(15)24h581012H349H212H3b1911+
MFCD06199324
ZINC000028627974
ZINC28627974
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