Vitas-M small molecule compound
(2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(4-methyl-3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK593418
SMILES N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=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 C22H12BrN3O4S MW 494.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12BrN3O4S/c1-12-2-3-13(7-19(12)26(28)29)6-15(10-24)21-25-18(11-31-21)17-9-14-8-16(23)4-5-20(14)30-22(17)27/h2-9,11H,1H3/b15-6-InChIKey
HFSUMPBSYIUCLB-UUASQNMZSA-NSynonyms
683255-67-6(2Z)2(4(6bromo2oxo2Hchromen3yl)13thiazol2yl)3(4methyl3nitrophenyl)prop2enenitrile
(Z)2(4(6bromo2oxo2Hchromen3yl)thiazol2yl)3(4methyl3nitrophenyl)acrylonitrile
(Z)2(4(6bromo2oxochromen3yl)13thiazol2yl)3(4methyl3nitrophenyl)prop2enenitrile
683255676
CC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O)(N+)(=O)(O)
InChI=1SC22H12BrN3O4Sc1122313(719(12)26(28)29)615(1024)212518(113121)17914816(23)4520(14)3022(17)27h2911H1H3b156
MFCD03670898
N#CC(=Cc1ccc(c(c1)(N+)(=O)(O))C)c1scc(n1)c1cc2cc(Br)ccc2oc1=O
ZINC000013658638
ZINC13658638
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