Vitas-M small molecule compound
2-amino-4-{2-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK052952
SMILES CCOc1cccc(c1OCc1ccccc1Cl)C1C(=C(N)Oc2c1c(=O)oc(c2)C)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 C25H21ClN2O5 MW 464.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O5/c1-3-30-19-10-6-8-16(23(19)31-13-15-7-4-5-9-18(15)26)21-17(12-27)24(28)33-20-11-14(2)32-25(29)22(20)21/h4-11,21H,3,13,28H2,1-2H3InChIKey
KWRAWRSXEKTXRN-UHFFFAOYSA-NSynonyms
364612-70-4(4R)2AMINO4(2((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2amino4(2((2chlorobenzyl)oxy)3ethoxyphenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(2((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(2((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
364612704
CCOC1=CC=CC(=C1OCC2=CC=CC=C2Cl)C3C(=C(OC4=C3C(=O)OC(=C4)C)N)C#N
CCOc1cccc(c1OCc1ccccc1Cl)C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N
InChI=1SC25H21ClN2O5c133019106816(23(19)311315745918(15)26)2117(1227)24(28)33201114(2)3225(29)22(20)21h41121H31328H212H3
MFCD03010810
STK052952
ZINC000001297181
ZINC000001297182
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