Vitas-M small molecule compound
methyl 6-{[4-(3-chlorophenyl)piperazin-1-yl]methyl}-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK986884
SMILES COC(=O)C1=C(CN2CCN(CC2)c2cccc(c2)Cl)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 C24H27ClN4O3 MW 454.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN4O3/c1-16-6-8-17(9-7-16)22-21(23(30)32-2)20(26-24(31)27-22)15-28-10-12-29(13-11-28)19-5-3-4-18(25)14-19/h3-9,14,22H,10-13,15H2,1-2H3,(H2,26,27,31)InChIKey
LRJRMERLCXTQCN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=CC(=CC=C4)Cl)C(=O)OC
InChI=1SC24H27ClN4O3c1166817(9716)2221(23(30)322)20(2624(31)2722)1528101229(131128)1953418(25)1419h391422H101315H212H3(H2262731)
methyl6((4(3chlorophenyl)piperazin1yl)methyl)4(4methylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl6((4(3chlorophenyl)piperazin1yl)methyl)4(4methylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
MFCD18183767
ZINC000051318402
ZINC000051318403
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