Vitas-M small molecule compound
3-chloro-N-(2-chloro-4-nitrophenyl)-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK343793
SMILES COc1ccc(cc1OC)c1nc2c(Cl)c(nn2c(c1)C(F)(F)F)C(=O)Nc1ccc(cc1Cl)[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 C22H14Cl2F3N5O5 MW 556.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl2F3N5O5/c1-36-15-6-3-10(7-16(15)37-2)14-9-17(22(25,26)27)31-20(28-14)18(24)19(30-31)21(33)29-13-5-4-11(32(34)35)8-12(13)23/h3-9H,1-2H3,(H,29,33)InChIKey
OWFJXNIQUCWDMZ-UHFFFAOYSA-NSynonyms
334500-05-9334500059
3chloroN(2chloro4nitrophenyl)5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
COC1=C(C=C(C=C1)C2=NC3=C(C(=NN3C(=C2)C(F)(F)F)C(=O)NC4=C(C=C(C=C4)(N+)(=O)(O))Cl)Cl)OC
COc1ccc(cc1OC)c1nc2c(Cl)c(nn2c(c1)C(F)(F)F)C(=O)Nc1ccc(cc1Cl)(N+)(=O)(O)
InChI=1SC22H14Cl2F3N5O5c136156310(716(15)372)14917(22(2526)27)3120(2814)18(24)19(3031)21(33)29135411(32(34)35)812(13)23h39H12H3(H2933)
MFCD01529292
ZINC000100086417
ZINC100086417
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