Vitas-M small molecule compound
3-chloro-N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-(4-chlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Catalog ID
STK676137
SMILES Clc1ccc(cc1)c1nc2c(Cl)c(nn2c(c1)C(F)(F)F)C(=O)Nc1cc(Oc2ccc(c(c2)C)Cl)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 C27H15Cl3F3N5O4 MW 636.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H15Cl3F3N5O4/c1-13-8-18(6-7-20(13)29)42-19-10-16(9-17(11-19)38(40)41)34-26(39)24-23(30)25-35-21(14-2-4-15(28)5-3-14)12-22(27(31,32)33)37(25)36-24/h2-12H,1H3,(H,34,39)InChIKey
UHCDQGLBHSJREY-UHFFFAOYSA-NSynonyms
3chloroN(3(4chloro3methylphenoxy)5nitrophenyl)5(4chlorophenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carboxamide
CC1=C(C=CC(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)C3=NN4C(=CC(=NC4=C3Cl)C5=CC=C(C=C5)Cl)C(F)(F)F)Cl
Clc1ccc(cc1)c1nc2c(Cl)c(nn2c(c1)C(F)(F)F)C(=O)Nc1cc(Oc2ccc(c(c2)C)Cl)cc(c1)(N+)(=O)(O)
InChI=1SC27H15Cl3F3N5O4c113818(6720(13)29)42191016(917(1119)38(40)41)3426(39)2423(30)253521(142415(28)5314)1222(27(3132)33)37(25)3624h212H1H3(H3439)
MFCD01529083
ZINC000150368444
ZINC150368444
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