Vitas-M small molecule compound

2-methoxyethyl 2-amino-4-(4-bromophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STK748050
SMILES COCCOC(=O)C1=C(N)OC2=C(C1c1ccc(cc1)Br)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 C19H20BrNO5 MW 422.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO5/c1-24-9-10-25-19(23)17-15(11-5-7-12(20)8-6-11)16-13(22)3-2-4-14(16)26-18(17)21/h5-8,15H,2-4,9-10,21H2,1H3
InChIKey
UAGKENLLQHHHSZ-UHFFFAOYSA-N
Synonyms
305867-61-2
2methoxyethyl2amino4(4bromophenyl)5oxo4678tetrahydrochromene3carboxylate
2methoxyethyl2amino4(4bromophenyl)5oxo5678tetrahydro4Hchromene3carboxylate
305867612
COCCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)Br)C(=O)CCC2)N
InChI=1SC19H20BrNO5c1249102519(23)1715(115712(20)8611)1613(22)32414(16)2618(17)21h5815H2491021H21H3
MFCD00742781
ZINC000002257266
ZINC000002257267

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Available files

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