Vitas-M small molecule compound
(2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Catalog ID
STK834319
SMILES N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/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 C22H13BrN4O4S MW 509.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13BrN4O4S/c1-12-6-16(27(29)30)3-4-18(12)25-10-14(9-24)21-26-19(11-32-21)17-8-13-7-15(23)2-5-20(13)31-22(17)28/h2-8,10-11,25H,1H3/b14-10+InChIKey
DQBJVORETXRNIH-GXDHUFHOSA-NSynonyms
371936-41-3(2E)2(4(6bromo2oxo2Hchromen3yl)13thiazol2yl)3((2methyl4nitrophenyl)amino)prop2enenitrile
(E)2(4(6bromo2oxo2Hchromen3yl)thiazol2yl)3((2methyl4nitrophenyl)amino)acrylonitrile
(E)2(4(6BROMO2OXOCHROMEN3YL)13THIAZOL2YL)3(2METHYL4NITROANILINO)PROP2ENENITRILE
371936413
CC1=C(C=CC(=C1)(N+)(=O)(O))NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O
InChI=1SC22H13BrN4O4Sc112616(27(29)30)3418(12)251014(924)212619(113221)17813715(23)2520(13)3122(17)28h28101125H1H3b1410+
MFCD01654282
N#CC(=CNc1ccc(cc1C)(N+)(=O)(O))c1scc(n1)c1cc2cc(Br)ccc2oc1=O
ZINC000008974631
ZINC08974631
ZINC8974631
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