Vitas-M small molecule compound
ethyl 2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL415989
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(c(c1)OCC)OCc1ccccc1Cl)C(=O)CCC2
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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 C27H28ClNO6 MW 497.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO6/c1-3-32-22-14-16(12-13-20(22)34-15-17-8-5-6-9-18(17)28)23-24-19(30)10-7-11-21(24)35-26(29)25(23)27(31)33-4-2/h5-6,8-9,12-14,23H,3-4,7,10-11,15,29H2,1-2H3InChIKey
BKDCSRLJZMDWNG-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC(=C2C(=O)OCC)N)OCC4=CC=CC=C4Cl
ethyl2amino4(4((2chlorobenzyl)oxy)3ethoxyphenyl)5oxo5678tetrahydro4Hchromene3carboxylate
ethyl2amino4(4((2chlorophenyl)methoxy)3ethoxyphenyl)5oxo4678tetrahydrochromene3carboxylate
InChI=1SC27H28ClNO6c1332221416(121320(22)341517856918(17)28)232419(30)1071121(24)3526(29)25(23)27(31)3342h5689121423H34710111529H212H3
MFCD04091413
ZINC000000639198
ZINC000008452840
ZINC00639198
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