Vitas-M small molecule compound

methyl 6-{[benzyl(methyl)amino]methyl}-4-(2-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027981
SMILES CCOc1ccccc1C1NC(=O)NC(=C1C(=O)OC)CN(Cc1ccccc1)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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-4-30-19-13-9-8-12-17(19)21-20(22(27)29-3)18(24-23(28)25-21)15-26(2)14-16-10-6-5-7-11-16/h5-13,21H,4,14-15H2,1-3H3,(H2,24,25,28)
InChIKey
XKDAEWDHIPQNKV-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC=C1C2C(=C(NC(=O)N2)CN(C)CC3=CC=CC=C3)C(=O)OC
InChI=1SC23H27N3O4c14301913981217(19)2120(22(27)293)18(2423(28)2521)1526(2)1416106571116h51321H41415H213H3(H2242528)
methyl6((benzyl(methyl)amino)methyl)4(2ethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((benzyl(methyl)amino)methyl)4(2ethoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD18188572
ZINC000057415672
ZINC000057415673

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Available files

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