Vitas-M small molecule compound
methyl 5,6-dicyano-3-[(4-methylphenyl)carbonyl]-1-benzofuran-2-carboxylate
Catalog ID
STL435609
SMILES COC(=O)c1oc2c(c1C(=O)c1ccc(cc1)C)cc(c(c2)C#N)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 C20H12N2O4 MW 344.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O4/c1-11-3-5-12(6-4-11)18(23)17-15-7-13(9-21)14(10-22)8-16(15)26-19(17)20(24)25-2/h3-8H,1-2H3InChIKey
VIGPFDPYRANYIN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)C2=C(OC3=C2C=C(C(=C3)C#N)C#N)C(=O)OC
InChI=1SC20H12N2O4c1113512(6411)18(23)1715713(921)14(1022)816(15)2619(17)20(24)252h38H12H3
methyl56dicyano3((4methylphenyl)carbonyl)1benzofuran2carboxylate
methyl56dicyano3(4methylbenzoyl)1benzofuran2carboxylate
MFCD25975689
ZINC000066089283
ZINC66089283
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