Vitas-M small molecule compound
2-[ethyl(3-methylphenyl)amino]-2-oxoethyl isoquinoline-1-carboxylate
Catalog ID
STL186958
SMILES CCN(c1cccc(c1)C)C(=O)COC(=O)c1nccc2c1cccc2
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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 C21H20N2O3 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3/c1-3-23(17-9-6-7-15(2)13-17)19(24)14-26-21(25)20-18-10-5-4-8-16(18)11-12-22-20/h4-13H,3,14H2,1-2H3InChIKey
PWGYCVCZVWUVIG-UHFFFAOYSA-NSynonyms
(2(Nethyl3methylanilino)2oxoethyl)isoquinoline1carboxylate
2(ethyl(3methylphenyl)amino)2oxoethylisoquinoline1carboxylate
CCN(C1=CC=CC(=C1)C)C(=O)COC(=O)C2=NC=CC3=CC=CC=C32
InChI=1SC21H20N2O3c1323(1796715(2)1317)19(24)142621(25)20181054816(18)11122220h413H314H212H3
MFCD22387965
ZINC000072330286
ZINC72330286
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