Vitas-M small molecule compound
(5E)-2-(4-butoxyphenyl)-5-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703144
SMILES CCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C/c1ccc(o1)c1cc(Cl)ccc1Cl)/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 C25H19Cl2N3O3S MW 512.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl2N3O3S/c1-2-3-12-32-17-7-4-15(5-8-17)23-28-25-30(29-23)24(31)22(34-25)14-18-9-11-21(33-18)19-13-16(26)6-10-20(19)27/h4-11,13-14H,2-3,12H2,1H3/b22-14+InChIKey
KWALYZUEKCEBPI-HYARGMPZSA-NSynonyms
(5E)2(4butoxyphenyl)5((5(25dichlorophenyl)furan2yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)2(4BUTOXYPHENYL)5((5(25DICHLOROPHENYL)FURAN2YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)2(4butoxyphenyl)5((5(25dichlorophenyl)furan2yl)methylene)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CC=C(O4)C5=C(C=CC(=C5)Cl)Cl)SC3=N2
CCCCOc1ccc(cc1)c1nn2c(n1)sc(=Cc1ccc(o1)c1cc(Cl)ccc1Cl)c2=O
InChI=1SC25H19Cl2N3O3Sc1231232177415(5817)23282530(2923)24(31)22(3425)141891121(3318)191316(26)61020(19)27h4111314H2312H21H3b2214+
MFCD04500779
ZINC000028467551
ZINC28467551
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