Vitas-M small molecule compound
ethyl 4-(4-nitrophenyl)-2-oxo-6-[(4-phenyl-3,6-dihydropyridin-1(2H)-yl)methyl]-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107632
SMILES CCOC(=O)C1=C(CN2CCC(=CC2)c2ccccc2)NC(=O)NC1c1ccc(cc1)[N+](=O)[O-]
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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 C25H26N4O5 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5/c1-2-34-24(30)22-21(16-28-14-12-18(13-15-28)17-6-4-3-5-7-17)26-25(31)27-23(22)19-8-10-20(11-9-19)29(32)33/h3-12,23H,2,13-16H2,1H3,(H2,26,27,31)InChIKey
STPVLJBXGWJJOT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(CN2CCC(=CC2)c2ccccc2)NC(=O)NC1c1ccc(cc1)(N+)(=O)(O)
CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)(N+)(=O)(O))CN3CCC(=CC3)C4=CC=CC=C4
ethyl4(4nitrophenyl)2oxo6((4phenyl36dihydro2Hpyridin1yl)methyl)34dihydro1Hpyrimidine5carboxylate
ethyl4(4nitrophenyl)2oxo6((4phenyl36dihydropyridin1(2H)yl)methyl)1234tetrahydropyrimidine5carboxylate
InChI=1SC25H26N4O5c123424(30)2221(1628141218(131528)176435717)2625(31)2723(22)1981020(11919)29(32)33h31223H21316H21H3(H2262731)
MFCD20741564
ZINC000067286295
ZINC000067286297
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