Vitas-M small molecule compound
methyl 2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL297170
SMILES COC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccccc1Cl)C(=O)CC(C2)(C)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 C26H26ClNO5 MW 467.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO5/c1-26(2)12-18(29)22-20(13-26)33-24(28)23(25(30)31-3)21(22)16-9-5-7-11-19(16)32-14-15-8-4-6-10-17(15)27/h4-11,21H,12-14,28H2,1-3H3InChIKey
BDYWRCPZUNHGSA-UHFFFAOYSA-NSynonyms
384349-77-3384349773
CC1(CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3OCC4=CC=CC=C4Cl)C(=O)C1)C
InChI=1SC26H26ClNO5c126(2)1218(29)2220(1326)3324(28)23(25(30)313)21(22)169571119(16)3214158461017(15)27h41121H121428H213H3
methyl2amino4(2((2chlorobenzyl)oxy)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
METHYL2AMINO4(2((2CHLOROPHENYL)METHOXY)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
MFCD03285167
ZINC000002319632
ZINC000002319633
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