Vitas-M small molecule compound
2-amino-4-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK046528
SMILES N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OCc1ccc(cc1)Cl)c(=O)oc(c2)C
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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 C24H19ClN2O5 MW 450.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O5/c1-13-9-20-22(24(28)31-13)21(17(11-26)23(27)32-20)15-5-8-18(19(10-15)29-2)30-12-14-3-6-16(25)7-4-14/h3-10,21H,12,27H2,1-2H3InChIKey
NTOQNZSYIVZBNJ-UHFFFAOYSA-NSynonyms
401590-02-12amino4(4((4chlorobenzyl)oxy)3methoxyphenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(4((4CHLOROBENZYL)OXY)3METHOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
401590021
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)Cl)OC)C(=O)O1
InChI=1SC24H19ClN2O5c11392022(24(28)3113)21(17(1126)23(27)3220)155818(19(1015)292)3012143616(25)7414h31021H1227H212H3
MFCD03008325
N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OCc1ccc(cc1)Cl)c(=O)oc(c2)C
STK046528
ZINC000001471966
ZINC000001471967
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