Vitas-M small molecule compound
N-[3-(4-chloro-2-cyclohexylphenoxy)-5-nitrophenyl]-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK676112
SMILES Clc1ccc(c(c1)C1CCCCC1)Oc1cc(NC(=O)c2cc3n(n2)c(cc(n3)c2ccc(c(c2)Cl)Cl)C(F)(F)F)cc(c1)[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 C32H23Cl3F3N5O4 MW 704.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23Cl3F3N5O4/c33-19-7-9-28(23(11-19)17-4-2-1-3-5-17)47-22-13-20(12-21(14-22)43(45)46)39-31(44)27-16-30-40-26(18-6-8-24(34)25(35)10-18)15-29(32(36,37)38)42(30)41-27/h6-17H,1-5H2,(H,39,44)InChIKey
QUNXMMJAYYMPBE-UHFFFAOYSA-NSynonyms
334498-99-6334498996
C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=CC(=CC(=C3)(N+)(=O)(O))NC(=O)C4=NN5C(=CC(=NC5=C4)C6=CC(=C(C=C6)Cl)Cl)C(F)(F)F
Clc1ccc(c(c1)C1CCCCC1)Oc1cc(NC(=O)c2cc3n(n2)c(cc(n3)c2ccc(c(c2)Cl)Cl)C(F)(F)F)cc(c1)(N+)(=O)(O)
InChI=1SC32H23Cl3F3N5O4c33197928(23(1119)174213517)47221320(1221(1422)43(45)46)3931(44)2716304026(186824(34)25(35)1018)1529(32(3637)38)42(30)4127h617H15H2(H3944)
MFCD01528510
N(3(4chloro2cyclohexylphenoxy)5nitrophenyl)5(34dichlorophenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
ZINC000008432498
ZINC08432498
ZINC8432498
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.