Vitas-M small molecule compound
2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Catalog ID
STK069552
SMILES CCOc1cc(ccc1OCc1ccccc1Cl)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/c1-3-30-20-11-15(8-9-19(20)31-13-16-6-4-5-7-18(16)26)22-17(12-27)24(28)33-21-10-14(2)32-25(29)23(21)22/h4-11,22H,3,13,28H2,1-2H3InChIKey
QKXPUMMTORXKDZ-UHFFFAOYSA-NSynonyms
712295-84-62amino4(4((2chlorobenzyl)oxy)3ethoxyphenyl)7methyl5oxo45dihydropyrano(43b)pyran3carbonitrile
2AMINO4(4((2CHLOROBENZYL)OXY)3ETHOXYPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBONITRILE
2AMINO4(4((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBONITRILE
712295846
CCOC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)OC(=C3)C)N)C#N)OCC4=CC=CC=C4Cl
CCOc1cc(ccc1OCc1ccccc1Cl)C1C(=C(N)Oc2c1c(=O)oc(c2)C)C#N
InChI=1SC25H21ClN2O5c1330201115(8919(20)311316645718(16)26)2217(1227)24(28)33211014(2)3225(29)23(21)22h41122H31328H212H3
MFCD03663162
STK069552
ZINC000002364868
ZINC000002364869
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