Vitas-M small molecule compound
methyl 2-amino-4-{3,5-dichloro-4-[(2-fluorobenzyl)oxy]phenyl}-7-(dimethylamino)-4H-chromene-3-carboxylate
Catalog ID
STL416514
SMILES COC(=O)C1=C(N)Oc2c(C1c1cc(Cl)c(c(c1)Cl)OCc1ccccc1F)ccc(c2)N(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 C26H23Cl2FN2O4 MW 517.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2FN2O4/c1-31(2)16-8-9-17-21(12-16)35-25(30)23(26(32)33-3)22(17)15-10-18(27)24(19(28)11-15)34-13-14-6-4-5-7-20(14)29/h4-12,22H,13,30H2,1-3H3InChIKey
DKVRESSVKJAGQV-UHFFFAOYSA-NSynonyms
CN(C)C1=CC2=C(C=C1)C(C(=C(O2)N)C(=O)OC)C3=CC(=C(C(=C3)Cl)OCC4=CC=CC=C4F)Cl
InChI=1SC26H23Cl2FN2O4c131(2)16891721(1216)3525(30)23(26(32)333)22(17)151018(27)24(19(28)1115)341314645720(14)29h41222H1330H213H3
methyl2amino4(35dichloro4((2fluorobenzyl)oxy)phenyl)7(dimethylamino)4Hchromene3carboxylate
METHYL2AMINO4(35DICHLORO4((2FLUOROPHENYL)METHOXY)PHENYL)7(DIMETHYLAMINO)4HCHROMENE3CARBOXYLATE
MFCD04091283
ZINC000002170026
ZINC000002170029
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