Vitas-M small molecule compound

ethyl 4-(4-ethylphenyl)-2-oxo-6-(piperidin-1-ylmethyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL107672
SMILES CCOC(=O)C1=C(CN2CCCCC2)NC(=O)NC1c1ccc(cc1)CC

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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 C21H29N3O3 MW 371.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O3/c1-3-15-8-10-16(11-9-15)19-18(20(25)27-4-2)17(22-21(26)23-19)14-24-12-6-5-7-13-24/h8-11,19H,3-7,12-14H2,1-2H3,(H2,22,23,26)
InChIKey
UVUILWJDDLYBER-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCCCC3)C(=O)OCC
ethyl4(4ethylphenyl)2oxo6(piperidin1ylmethyl)1234tetrahydropyrimidine5carboxylate
ethyl4(4ethylphenyl)2oxo6(piperidin1ylmethyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H29N3O3c131581016(11915)1918(20(25)2742)17(2221(26)2319)1424126571324h81119H371214H212H3(H2222326)
MFCD20741600
ZINC000067286514
ZINC000067286519

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Available files

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