Vitas-M small molecule compound
ethyl 6-(4-nitrophenyl)-4-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK292052
SMILES CCOC(=O)C1C(=O)N=C(NC1c1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccccn1
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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 C22H24N6O5 MW 452.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N6O5/c1-2-33-21(30)18-19(15-6-8-16(9-7-15)28(31)32)24-22(25-20(18)29)27-13-11-26(12-14-27)17-5-3-4-10-23-17/h3-10,18-19H,2,11-14H2,1H3,(H,24,25,29)InChIKey
AASUAIKMWXKHMS-UHFFFAOYSA-NSynonyms
908497-47-2908497472
CCOC(=O)C1C(=O)N=C(NC1c1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)c1ccccn1
CCOC(=O)C1C(N=C(NC1=O)N2CCN(CC2)C3=CC=CC=N3)C4=CC=C(C=C4)(N+)(=O)(O)
ethyl4(4nitrophenyl)6oxo2(4pyridin2ylpiperazin1yl)45dihydro1Hpyrimidine5carboxylate
ethyl6(4nitrophenyl)4oxo2(4(pyridin2yl)piperazin1yl)1456tetrahydropyrimidine5carboxylate
InChI=1SC22H24N6O5c123321(30)1819(156816(9715)28(31)32)2422(2520(18)29)27131126(121427)17534102317h3101819H21114H21H3(H242529)
MFCD08592704
ZINC000018156259
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