Vitas-M small molecule compound

methyl 2-amino-4-(2,4-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carboxylate

Catalog ID
STK031576
SMILES COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1Cl)Cl)c(=O)oc(c2)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 C17H13Cl2NO5 MW 382.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2NO5/c1-7-5-11-13(17(22)24-7)12(9-4-3-8(18)6-10(9)19)14(15(20)25-11)16(21)23-2/h3-6,12H,20H2,1-2H3
InChIKey
UVMDOOHKKDSVJI-UHFFFAOYSA-N
Synonyms
327100-48-1
327100481
CC1=CC2=C(C(C(=C(O2)N)C(=O)OC)C3=C(C=C(C=C3)Cl)Cl)C(=O)O1
COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1Cl)Cl)c(=O)oc(c2)C
InChI=1SC17H13Cl2NO5c1751113(17(22)247)12(9438(18)610(9)19)14(15(20)2511)16(21)232h3612H20H212H3
METHYL(4S)2AMINO4(24DICHLOROPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBOXYLATE
METHYL2AMINO4(24DICHLOROPHENYL)7METHYL5OXO45DIHYDROPYRANO(43B)PYRAN3CARBOXYLATE
METHYL2AMINO4(24DICHLOROPHENYL)7METHYL5OXO4H5HPYRANO(43B)PYRAN3CARBOXYLATE
METHYL2AMINO4(24DICHLOROPHENYL)7METHYL5OXO4HPYRANO(32C)PYRAN3CARBOXYLATE
MFCD01554792
STK031576
ZINC000001107859
ZINC000001107860

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.