Vitas-M small molecule compound
methyl 2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL379745
SMILES COC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccccc1Cl)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 C24H22ClNO5 MW 439.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClNO5/c1-29-24(28)22-20(21-17(27)10-6-12-19(21)31-23(22)26)15-8-3-5-11-18(15)30-13-14-7-2-4-9-16(14)25/h2-5,7-9,11,20H,6,10,12-13,26H2,1H3InChIKey
HGHIXVBMROFGIB-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(OC2=C(C1C3=CC=CC=C3OCC4=CC=CC=C4Cl)C(=O)CCC2)N
InChI=1SC24H22ClNO5c12924(28)2220(2117(27)1061219(21)3123(22)26)158351118(15)301314724916(14)25h25791120H610121326H21H3
methyl2amino4(2((2chlorobenzyl)oxy)phenyl)5oxo5678tetrahydro4Hchromene3carboxylate
methyl2amino4(2((2chlorophenyl)methoxy)phenyl)5oxo4678tetrahydrochromene3carboxylate
MFCD04087032
ZINC000001106933
ZINC000001106934
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