Vitas-M small molecule compound
ethyl 4-[4-(methylsulfanyl)phenyl]-2-oxo-6-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107761
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2ccccn2)NC(=O)NC1c1ccc(cc1)SC
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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 C24H29N5O3S MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5O3S/c1-3-32-23(30)21-19(16-28-12-14-29(15-13-28)20-6-4-5-11-25-20)26-24(31)27-22(21)17-7-9-18(33-2)10-8-17/h4-11,22H,3,12-16H2,1-2H3,(H2,26,27,31)InChIKey
DKPAYAJNDJQVSE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)SC)CN3CCN(CC3)C4=CC=CC=N4
ethyl4(4(methylsulfanyl)phenyl)2oxo6((4(pyridin2yl)piperazin1yl)methyl)1234tetrahydropyrimidine5carboxylate
ethyl4(4methylsulfanylphenyl)2oxo6((4pyridin2ylpiperazin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
InChI=1SC24H29N5O3Sc133223(30)2119(1628121429(151328)20645112520)2624(31)2722(21)177918(332)10817h41122H31216H212H3(H2262731)
MFCD20741689
ZINC000067287029
ZINC000067287030
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