Vitas-M small molecule compound
ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-nitrophenoxy)pyrimidine-5-carboxylate
Catalog ID
STL054500
SMILES CCOC(=O)c1cnc(nc1Oc1ccc(cc1)[N+](=O)[O-])n1nc(cc1C)C
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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 C18H17N5O5 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O5/c1-4-27-17(24)15-10-19-18(22-12(3)9-11(2)21-22)20-16(15)28-14-7-5-13(6-8-14)23(25)26/h5-10H,4H2,1-3H3InChIKey
SSGUSVSCDWPACS-UHFFFAOYSA-NSynonyms
1002008-23-21002008232
CCOC(=O)C1=CN=C(N=C1OC2=CC=C(C=C2)(N+)(=O)(O))N3C(=CC(=N3)C)C
CCOC(=O)c1cnc(nc1Oc1ccc(cc1)(N+)(=O)(O))n1nc(cc1C)C
ethyl2(35dimethyl1Hpyrazol1yl)4(4nitrophenoxy)pyrimidine5carboxylate
ETHYL2(35DIMETHYLPYRAZOL1YL)4(4NITROPHENOXY)PYRIMIDINE5CARBOXYLATE
InChI=1SC18H17N5O5c142717(24)15101918(2212(3)911(2)2122)2016(15)28147513(6814)23(25)26h510H4H213H3
MFCD04023719
ZINC000005072138
ZINC05072138
ZINC5072138
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