Vitas-M small molecule compound
ethyl 6-(3-nitrophenyl)-4-oxo-2-(piperidin-1-yl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK356269
SMILES CCOC(=O)C1C(=O)N=C(NC1c1cccc(c1)[N+](=O)[O-])N1CCCCC1
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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 C18H22N4O5 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O5/c1-2-27-17(24)14-15(12-7-6-8-13(11-12)22(25)26)19-18(20-16(14)23)21-9-4-3-5-10-21/h6-8,11,14-15H,2-5,9-10H2,1H3,(H,19,20,23)InChIKey
RFGMMIIJMZSGAZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1C(=O)N=C(NC1c1cccc(c1)(N+)(=O)(O))N1CCCCC1
CCOC(=O)C1C(N=C(NC1=O)N2CCCCC2)C3=CC(=CC=C3)(N+)(=O)(O)
ethyl4(3nitrophenyl)6oxo2piperidin1yl45dihydro1Hpyrimidine5carboxylate
ETHYL4(3NITROPHENYL)6OXO2PIPERIDYL345TRIHYDROPYRIMIDINE5CARBOXYLATE
ethyl6(3nitrophenyl)4oxo2(piperidin1yl)1456tetrahydropyrimidine5carboxylate
InChI=1SC18H22N4O5c122717(24)1415(1276813(1112)22(25)26)1918(2016(14)23)2194351021h68111415H25910H21H3(H192023)
MFCD08088119
ZINC000014162904
ZINC000014162913
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