Vitas-M small molecule compound
ethyl 4-(2-chlorophenyl)-2-oxo-6-{[4-(prop-2-en-1-yl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107823
SMILES C=CCN1CCN(CC1)CC1=C(C(=O)OCC)C(NC(=O)N1)c1ccccc1Cl
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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 C21H27ClN4O3 MW 418.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN4O3/c1-3-9-25-10-12-26(13-11-25)14-17-18(20(27)29-4-2)19(24-21(28)23-17)15-7-5-6-8-16(15)22/h3,5-8,19H,1,4,9-14H2,2H3,(H2,23,24,28)InChIKey
CZIOCUDTKDJDRF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2Cl)CN3CCN(CC3)CC=C
ethyl4(2chlorophenyl)2oxo6((4(prop2en1yl)piperazin1yl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl4(2chlorophenyl)2oxo6((4prop2enylpiperazin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H27ClN4O3c13925101226(131125)141718(20(27)2942)19(2421(28)2317)15756816(15)22h35819H14914H22H3(H2232428)
MFCD20741738
ZINC000067287352
ZINC000067287354
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