Vitas-M small molecule compound

ethyl 6-[(4-carbamoylpiperidin-1-yl)methyl]-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL027935
SMILES CCOC(=O)C1=C(CN2CCC(CC2)C(=O)N)NC(=O)NC1c1ccc(cc1)OCC

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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 C22H30N4O5 MW 430.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O5/c1-3-30-16-7-5-14(6-8-16)19-18(21(28)31-4-2)17(24-22(29)25-19)13-26-11-9-15(10-12-26)20(23)27/h5-8,15,19H,3-4,9-13H2,1-2H3,(H2,23,27)(H2,24,25,29)
InChIKey
VMGZKUZGOLEXTG-UHFFFAOYSA-N
Synonyms

CCOC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCC(CC3)C(=O)N)C(=O)OCC
ethyl6((4carbamoylpiperidin1yl)methyl)4(4ethoxyphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4carbamoylpiperidin1yl)methyl)4(4ethoxyphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC22H30N4O5c1330167514(6816)1918(21(28)3142)17(2422(29)2519)132611915(101226)20(23)27h581519H34913H212H3(H22327)(H2242529)
MFCD18188526
ZINC000057415501
ZINC000057415503

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Available files

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