Vitas-M small molecule compound

ethyl 4-[(2-bromophenyl)carbamoyl]-2-methyl-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate

Catalog ID
STL444815
SMILES CCOC(=O)C1=C(C)NC(=O)CC1C(=O)Nc1ccccc1Br

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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 C16H17BrN2O4 MW 381.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN2O4/c1-3-23-16(22)14-9(2)18-13(20)8-10(14)15(21)19-12-7-5-4-6-11(12)17/h4-7,10H,3,8H2,1-2H3,(H,18,20)(H,19,21)
InChIKey
LMNWCRUXFNRNAZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)CC1C(=O)NC2=CC=CC=C2Br)C
ethyl4((2bromophenyl)carbamoyl)2methyl6oxo1456tetrahydropyridine3carboxylate
ETHYL4((2BROMOPHENYL)CARBAMOYL)6METHYL2OXO34DIHYDRO1HPYRIDINE5CARBOXYLATE
ETHYL4(N(2BROMOPHENYL)CARBAMOYL)2METHYL6OXO145TRIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC16H17BrN2O4c132316(22)149(2)1813(20)810(14)15(21)1912754611(12)17h4710H38H212H3(H1820)(H1921)
MFCD07469472
ZINC000004999279
ZINC000004999280

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Available files

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