Vitas-M small molecule compound
ethyl 6-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-4-(4-ethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL073309
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2cc(Cl)ccc2C)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 C27H33ClN4O3 MW 497.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33ClN4O3/c1-4-19-7-9-20(10-8-19)25-24(26(33)35-5-2)22(29-27(34)30-25)17-31-12-14-32(15-13-31)23-16-21(28)11-6-18(23)3/h6-11,16,25H,4-5,12-15,17H2,1-3H3,(H2,29,30,34)InChIKey
OFQHEVSFEGJCLX-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CN3CCN(CC3)C4=C(C=CC(=C4)Cl)C)C(=O)OCC
ethyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl6((4(5chloro2methylphenyl)piperazin1yl)methyl)4(4ethylphenyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC27H33ClN4O3c14197920(10819)2524(26(33)3552)22(2927(34)3025)1731121432(151331)231621(28)11618(23)3h6111625H45121517H213H3(H2293034)
MFCD18194845
ZINC000067205244
ZINC000067205247
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