Vitas-M small molecule compound
benzyl 2-amino-5-cyano-4-(2-fluorophenyl)-6-methyl-4H-pyran-3-carboxylate
Catalog ID
STL171954
SMILES N#CC1=C(C)OC(=C(C1c1ccccc1F)C(=O)OCc1ccccc1)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 C21H17FN2O3 MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN2O3/c1-13-16(11-23)18(15-9-5-6-10-17(15)22)19(20(24)27-13)21(25)26-12-14-7-3-2-4-8-14/h2-10,18H,12,24H2,1H3InChIKey
KQZOKJBISRRLJB-UHFFFAOYSA-NSynonyms
BENZYL(4S)2AMINO5CYANO4(2FLUOROPHENYL)6METHYL4HPYRAN3CARBOXYLATE
benzyl2amino5cyano4(2fluorophenyl)6methyl4Hpyran3carboxylate
CC1=C(C(C(=C(O1)N)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3F)C#N
InChI=1SC21H17FN2O3c11316(1123)18(159561017(15)22)19(20(24)2713)21(25)2612147324814h21018H1224H21H3
MFCD01243698
ZINC000000994154
ZINC000000994155
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