Vitas-M small molecule compound
2-(4-fluorophenyl)-4-methyl-3-oxo-5-[2-(4-sulfamoylphenyl)ethyl]-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate
Catalog ID
STL043141
SMILES Fc1ccc(cc1)n1nc2c(c1=O)c(C)n(c(c2)[O-])CCc1ccc(cc1)S(=O)(=O)N
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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 C21H18FN4O4S MW 441.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O4S/c1-13-20-18(24-26(21(20)28)16-6-4-15(22)5-7-16)12-19(27)25(13)11-10-14-2-8-17(9-3-14)31(23,29)30/h2-9,12,27H,10-11H2,1H3,(H2,23,29,30)/p-1InChIKey
IKJJRVAITNIFNP-UHFFFAOYSA-MSynonyms
2(4fluorophenyl)4methyl3oxo5(2(4sulfamoylphenyl)ethyl)35dihydro2Hpyrazolo(43c)pyridin6olate
2(4fluorophenyl)4methyl3oxo5(2(4sulfamoylphenyl)ethyl)pyrazolo(43c)pyridin6olate
CC1=C2C(=NN(C2=O)C3=CC=C(C=C3)F)C=C(N1CCC4=CC=C(C=C4)S(=O)(=O)N)(O)
Fc1ccc(cc1)n1nc2c(c1=O)c(C)n(c(c2)(O))CCc1ccc(cc1)S(=O)(=O)N
Fc1ccc(cc1)n1nc2c(c1=O)c(C)n(c(c2)(O))CCc1ccc(cc1)S(=O)(=O)N(Na+)
InChI=1SC21H19FN4O4Sc1132018(2426(21(20)28)166415(22)5716)1219(27)25(13)1110142817(9314)31(2329)30h291227H1011H21H3(H2232930)p1
sodium2(4fluorophenyl)4methyl3oxo5(4sulfamoylphenethyl)35dihydro2Hpyrazolo(43c)pyridin6olate
ZINC000012408218
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