Vitas-M small molecule compound
4-[5-(2-fluorophenyl)-3-{3-[(methylsulfonyl)amino]phenyl}-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STK733009
SMILES OC(=O)CCC(=O)N1N=C(CC1c1ccccc1F)c1cccc(c1)NS(=O)(=O)C
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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 C20H20FN3O5S MW 433.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN3O5S/c1-30(28,29)23-14-6-4-5-13(11-14)17-12-18(15-7-2-3-8-16(15)21)24(22-17)19(25)9-10-20(26)27/h2-8,11,18,23H,9-10,12H2,1H3,(H,26,27)InChIKey
GJXSLWRSZBKEMG-UHFFFAOYSA-NSynonyms
851719-18-14(3(2FLUOROPHENYL)5(3(METHANESULFONAMIDO)PHENYL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(5(2fluorophenyl)3(3((methylsulfonyl)amino)phenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(2fluorophenyl)3(3(methylsulfonamido)phenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
851719181
CS(=O)(=O)NC1=CC=CC(=C1)C2=NN(C(C2)C3=CC=CC=C3F)C(=O)CCC(=O)O
InChI=1SC20H20FN3O5Sc130(2829)231464513(1114)171218(15723816(15)21)24(2217)19(25)91020(26)27h28111823H91012H21H3(H2627)
MFCD04463734
ZINC000009410920
ZINC000009410921
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