Vitas-M small molecule compound
ethyl 6-amino-4-{5-[(4-chloro-3-methylphenoxy)methyl]furan-2-yl}-5-cyano-2-methyl-4H-pyran-3-carboxylate
Catalog ID
STK961016
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1ccc(o1)COc1ccc(c(c1)C)Cl)C#N)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 C22H21ClN2O5 MW 428.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN2O5/c1-4-27-22(26)19-13(3)29-21(25)16(10-24)20(19)18-8-6-15(30-18)11-28-14-5-7-17(23)12(2)9-14/h5-9,20H,4,11,25H2,1-3H3InChIKey
CISGMZQYAWLMHP-UHFFFAOYSA-NSynonyms
445232-25-7445232257
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(O2)COC3=CC(=C(C=C3)Cl)C)C#N)N)C
ETHYL6AMINO4(5((4CHLORO3METHYLPHENOXY)METHYL)2FURYL)5CYANO2METHYL4HPYRAN3CARBOXYLATE
ethyl6amino4(5((4chloro3methylphenoxy)methyl)furan2yl)5cyano2methyl4Hpyran3carboxylate
InChI=1SC22H21ClN2O5c142722(26)1913(3)2921(25)16(1024)20(19)188615(3018)1128145717(23)12(2)914h5920H41125H213H3
MFCD02243727
ZINC000000649235
ZINC000000649236
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