Vitas-M small molecule compound
ethyl 4-[(2-chloro-4-nitrophenyl)amino]-2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine-5-carboxylate
Catalog ID
STK569204
SMILES CCOC(=O)c1cnc(nc1Nc1ccc(cc1Cl)[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 C18H17ClN6O4 MW 416.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN6O4/c1-4-29-17(26)13-9-20-18(24-11(3)7-10(2)23-24)22-16(13)21-15-6-5-12(25(27)28)8-14(15)19/h5-9H,4H2,1-3H3,(H,20,21,22)InChIKey
GDDGOEYUYCXCEQ-UHFFFAOYSA-NSynonyms
1001466-43-81001466438
CCOC(=O)C1=CN=C(N=C1NC2=C(C=C(C=C2)(N+)(=O)(O))Cl)N3C(=CC(=N3)C)C
CCOC(=O)c1cnc(nc1Nc1ccc(cc1Cl)(N+)(=O)(O))n1nc(cc1C)C
ethyl4((2chloro4nitrophenyl)amino)2(35dimethyl1Hpyrazol1yl)pyrimidine5carboxylate
ETHYL4(2CHLORO4NITROANILINO)2(35DIMETHYLPYRAZOL1YL)PYRIMIDINE5CARBOXYLATE
InChI=1SC18H17ClN6O4c142917(26)1392018(2411(3)710(2)2324)2216(13)21156512(25(27)28)814(15)19h59H4H213H3(H202122)
MFCD04016378
ZINC000005046956
ZINC05046956
ZINC5046956
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