Vitas-M small molecule compound

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

Catalog ID
STL073315
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2ccccc2C)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 C27H34N4O3 MW 462.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O3/c1-4-20-10-12-21(13-11-20)25-24(26(32)34-5-2)22(28-27(33)29-25)18-30-14-16-31(17-15-30)23-9-7-6-8-19(23)3/h6-13,25H,4-5,14-18H2,1-3H3,(H2,28,29,33)
InChIKey
CYVMTTQCXZHPPI-UHFFFAOYSA-N
Synonyms

CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=CC=CC=C4C)C(=O)OCC
ethyl4(4ethylphenyl)6((4(2methylphenyl)piperazin1yl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(4ethylphenyl)6((4(2methylphenyl)piperazin1yl)methyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC27H34N4O3c1420101221(131120)2524(26(32)3452)22(2827(33)2925)1830141631(171530)23976819(23)3h61325H451418H213H3(H2282933)
MFCD18194851
ZINC000057478480
ZINC000057478482

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Available files

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