Vitas-M small molecule compound
ethyl (2E)-2-cyano-3-[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]prop-2-enoate
Catalog ID
STK006773
SMILES CCOC(=O)/C(=C/c1cn(c2c1cccc2)Cc1ccc(cc1Cl)Cl)/C#N
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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 C21H16Cl2N2O2 MW 399.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O2/c1-2-27-21(26)15(11-24)9-16-13-25(20-6-4-3-5-18(16)20)12-14-7-8-17(22)10-19(14)23/h3-10,13H,2,12H2,1H3/b15-9+InChIKey
NPPCUHBVVPCURZ-OQLLNIDSSA-NSynonyms
CCOC(=O)C(=CC1=CN(C2=CC=CC=C21)CC3=C(C=C(C=C3)Cl)Cl)C#N
CCOC(=O)C(=Cc1cn(c2c1cccc2)Cc1ccc(cc1Cl)Cl)C#N
ETHYL(2E)2CYANO3(1(24DICHLOROBENZYL)1HINDOL3YL)PROP2ENOATE
ETHYL(2E)3(1((24DICHLOROPHENYL)METHYL)INDOL3YL)2CYANOPROP2ENOATE
ETHYL(E)2CYANO3(1((24DICHLOROPHENYL)METHYL)INDOL3YL)PROP2ENOATE
InChI=1SC21H16Cl2N2O2c122721(26)15(1124)9161325(20643518(16)20)12147817(22)1019(14)23h31013H212H21H3b159+
MFCD02126059
STK006773
ZINC000004082450
ZINC04082450
ZINC4082450
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