Vitas-M small molecule compound
(2E)-3-[1-(3-bromobenzyl)-1H-indol-3-yl]-2-cyano-N-(2,4-dimethoxyphenyl)prop-2-enamide
Catalog ID
STK473312
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1cccc(c1)Br)/C(=O)Nc1ccc(cc1OC)OC
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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 C27H22BrN3O3 MW 516.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22BrN3O3/c1-33-22-10-11-24(26(14-22)34-2)30-27(32)19(15-29)13-20-17-31(25-9-4-3-8-23(20)25)16-18-6-5-7-21(28)12-18/h3-14,17H,16H2,1-2H3,(H,30,32)/b19-13+InChIKey
PRVUNDCAGXJFDV-CPNJWEJPSA-NSynonyms
(2E)3(1(3bromobenzyl)1Hindol3yl)2cyanoN(24dimethoxyphenyl)prop2enamide
(2E)N(24DIMETHOXYPHENYL)3(1((3BROMOPHENYL)METHYL)INDOL3YL)2CYANOPROP2ENAMIDE
(E)3(1((3bromophenyl)methyl)indol3yl)2cyanoN(24dimethoxyphenyl)prop2enamide
COC1=CC(=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC(=CC=C4)Br)C#N)OC
InChI=1SC27H22BrN3O3c13322101124(26(1422)342)3027(32)19(1529)13201731(25943823(20)25)161865721(28)1218h31417H16H212H3(H3032)b1913+
MFCD07089043
N#CC(=Cc1cn(c2c1cccc2)Cc1cccc(c1)Br)C(=O)Nc1ccc(cc1OC)OC
ZINC000020247424
ZINC20247424
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