Vitas-M small molecule compound

ethyl 4-(4-methylphenyl)-2-oxo-6-{[4-(propan-2-yl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK986920
SMILES CCOC(=O)C1=C(CN2CCN(CC2)C(C)C)NC(=O)NC1c1ccc(cc1)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 C22H32N4O3 MW 400.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N4O3/c1-5-29-21(27)19-18(14-25-10-12-26(13-11-25)15(2)3)23-22(28)24-20(19)17-8-6-16(4)7-9-17/h6-9,15,20H,5,10-14H2,1-4H3,(H2,23,24,28)
InChIKey
RBSSRPYEKXRBBY-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)C)CN3CCN(CC3)C(C)C
ethyl4(4methylphenyl)2oxo6((4(propan2yl)piperazin1yl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl4(4methylphenyl)2oxo6((4propan2ylpiperazin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC22H32N4O3c152921(27)1918(1425101226(131125)15(2)3)2322(28)2420(19)178616(4)7917h691520H51014H214H3(H2232428)
MFCD18183788
ZINC000051318483
ZINC000051318484

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Available files

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