Vitas-M small molecule compound
methyl 3-{3-[(2-chlorobenzyl)amino]-2-cyano-3-oxopropyl}-1H-indole-4-carboxylate
Catalog ID
STL157599
SMILES N#CC(C(=O)NCc1ccccc1Cl)Cc1c[nH]c2c1c(ccc2)C(=O)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 C21H18ClN3O3 MW 395.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3/c1-28-21(27)16-6-4-8-18-19(16)15(12-24-18)9-14(10-23)20(26)25-11-13-5-2-3-7-17(13)22/h2-8,12,14,24H,9,11H2,1H3,(H,25,26)InChIKey
PYKOJVAPDYAGOA-UHFFFAOYSA-NSynonyms
1282123-66-31282123663
COC(=O)C1=C2C(=CC=C1)NC=C2CC(C#N)C(=O)NCC3=CC=CC=C3Cl
InChI=1SC21H18ClN3O3c12821(27)166481819(16)15(122418)914(1023)20(26)251113523717(13)22h28121424H911H21H3(H2526)
methyl3(3((2chlorobenzyl)amino)2cyano3oxopropyl)1Hindole4carboxylate
methyl3(3((2chlorophenyl)methylamino)2cyano3oxopropyl)1Hindole4carboxylate
MFCD18797671
N#CC(C(=O)NCc1ccccc1Cl)Cc1c(nH)c2c1c(ccc2)C(=O)OC
ZINC000061718966
ZINC000061718967
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