Vitas-M small molecule compound
methyl 4-({(E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Catalog ID
STK878477
SMILES N#C/C(=C\Nc1ccc(cc1)C(=O)OC)/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 C23H14BrN3O4S MW 508.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14BrN3O4S/c1-30-22(28)13-2-5-17(6-3-13)26-11-15(10-25)21-27-19(12-32-21)18-9-14-8-16(24)4-7-20(14)31-23(18)29/h2-9,11-12,26H,1H3/b15-11+InChIKey
BQOQLHZYUMVLBE-RVDMUPIBSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Br)OC3=O
InChI=1SC23H14BrN3O4Sc13022(28)132517(6313)261115(1025)212719(123221)18914816(24)4720(14)3123(18)29h29111226H1H3b1511+
methyl4(((E)2(4(6bromo2oxo2Hchromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
methyl4(((E)2(4(6bromo2oxochromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
MFCD18170318
N#CC(=CNc1ccc(cc1)C(=O)OC)c1scc(n1)c1cc2cc(Br)ccc2oc1=O
ZINC000040476957
ZINC40476957
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