Vitas-M small molecule compound

2-chloroethyl (2E)-3-(1-benzyl-1H-indol-3-yl)-2-cyanoprop-2-enoate

Catalog ID
STK740164
SMILES ClCCOC(=O)/C(=C/c1cn(c2c1cccc2)Cc1ccccc1)/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 C21H17ClN2O2 MW 364.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O2/c22-10-11-26-21(25)17(13-23)12-18-15-24(14-16-6-2-1-3-7-16)20-9-5-4-8-19(18)20/h1-9,12,15H,10-11,14H2/b17-12+
InChIKey
GIYSXJSVIFKFDZ-SFQUDFHCSA-N
Synonyms
372973-07-4
(E)2chloroethyl3(1benzyl1Hindol3yl)2cyanoacrylate
2CHLOROETHYL(2E)2CYANO3(1BENZYLINDOL3YL)PROP2ENOATE
2chloroethyl(2E)3(1benzyl1Hindol3yl)2cyanoprop2enoate
2CHLOROETHYL(E)3(1BENZYLINDOL3YL)2CYANOPROP2ENOATE
372973074
C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C(C#N)C(=O)OCCCl
ClCCOC(=O)C(=Cc1cn(c2c1cccc2)Cc1ccccc1)C#N
InChI=1SC21H17ClN2O2c2210112621(25)17(1323)12181524(14166213716)20954819(18)20h191215H101114H2b1712+
MFCD01953553
ZINC000002230560
ZINC02230560
ZINC2230560

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Available files

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