Vitas-M small molecule compound
N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-fluorobenzamide
Catalog ID
STL236302
SMILES COc1ccc(cc1)c1nn(c(c1)NC(=O)c1ccc(cc1)F)C1CCS(=O)(=O)C1
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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 C21H20FN3O4S MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O4S/c1-29-18-8-4-14(5-9-18)19-12-20(23-21(26)15-2-6-16(22)7-3-15)25(24-19)17-10-11-30(27,28)13-17/h2-9,12,17H,10-11,13H2,1H3,(H,23,26)InChIKey
WPFDOUPMKBOQGV-UHFFFAOYSA-NSynonyms
1010864-87-51010864875
COC1=CC=C(C=C1)C2=NN(C(=C2)NC(=O)C3=CC=C(C=C3)F)C4CCS(=O)(=O)C4
InChI=1SC21H20FN3O4Sc129188414(5918)191220(2321(26)152616(22)7315)25(2419)17101130(2728)1317h291217H101113H21H3(H2326)
MFCD09857300
N(1(11dioxidotetrahydrothiophen3yl)3(4methoxyphenyl)1Hpyrazol5yl)4fluorobenzamide
N(2(11dioxothiolan3yl)5(4methoxyphenyl)pyrazol3yl)4fluorobenzamide
ZINC000013729732
ZINC000013729735
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