Vitas-M small molecule compound
ethyl 4-[(2-cyanophenyl)amino]-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate
Catalog ID
STK773160
SMILES CCOC(=O)C1C(=O)C=C(CC1c1ccccc1)Nc1ccccc1C#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 C22H20N2O3 MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3/c1-2-27-22(26)21-18(15-8-4-3-5-9-15)12-17(13-20(21)25)24-19-11-7-6-10-16(19)14-23/h3-11,13,18,21,24H,2,12H2,1H3InChIKey
OLWLAXYIZFLXQE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(CC(=CC1=O)NC2=CC=CC=C2C#N)C3=CC=CC=C3
ETHYL(1R6R)4((2CYANOPHENYL)AMINO)2OXO6PHENYLCYCLOHEX3ENE1CARBOXYLATE
ETHYL(1R6S)4((2CYANOPHENYL)AMINO)2OXO6PHENYLCYCLOHEX3ENE1CARBOXYLATE
ethyl4((2cyanophenyl)amino)2oxo6phenylcyclohex3ene1carboxylate
ETHYL4(2CYANOANILINO)2OXO6PHENYLCYCLOHEX3ENE1CARBOXYLATE
InChI=1SC22H20N2O3c122722(26)2118(158435915)1217(1320(21)25)241911761016(19)1423h31113182124H212H21H3
MFCD03821352
ZINC000001080024
ZINC000001080027
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