Vitas-M small molecule compound
methyl (3-{(1E)-2-cyano-3-[(2-ethylphenyl)amino]-3-oxoprop-1-en-1-yl}-1H-indol-1-yl)acetate
Catalog ID
STK186113
SMILES N#C/C(=C\c1cn(c2c1cccc2)CC(=O)OC)/C(=O)Nc1ccccc1CC
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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 C23H21N3O3 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3/c1-3-16-8-4-6-10-20(16)25-23(28)17(13-24)12-18-14-26(15-22(27)29-2)21-11-7-5-9-19(18)21/h4-12,14H,3,15H2,1-2H3,(H,25,28)/b17-12+InChIKey
JYFTUOLMZJVRIL-SFQUDFHCSA-NSynonyms
(E)methyl2(3(2cyano3((2ethylphenyl)amino)3oxoprop1en1yl)1Hindol1yl)acetate
CCC1=CC=CC=C1NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)OC)C#N
InChI=1SC23H21N3O3c13168461020(16)2523(28)17(1324)12181426(1522(27)292)211175919(18)21h41214H315H212H3(H2528)b1712+
METHYL(3((1E)2CYANO3((2ETHYLPHENYL)AMINO)3OXOPROP1EN1YL)1HINDOL1YL)ACETATE
METHYL2(3((E)2CYANO3(2ETHYLANILINO)3OXOPROP1ENYL)INDOL1YL)ACETATE
MFCD02904887
N#CC(=Cc1cn(c2c1cccc2)CC(=O)OC)C(=O)Nc1ccccc1CC
ZINC000004711220
ZINC04711220
ZINC4711220
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