Vitas-M small molecule compound
4-[(4Z)-4-[4-(diethylamino)benzylidene]-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide
Catalog ID
STK027701
SMILES CCN(c1ccc(cc1)/C=C/1\C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)S(=O)(=O)N)CC
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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 C21H21F3N4O3S MW 466.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4O3S/c1-3-27(4-2)15-7-5-14(6-8-15)13-18-19(21(22,23)24)26-28(20(18)29)16-9-11-17(12-10-16)32(25,30)31/h5-13H,3-4H2,1-2H3,(H2,25,30,31)/b18-13-InChIKey
YNUFGUURDQNQPJ-AQTBWJFISA-NSynonyms
4((4Z)4((4(DIETHYLAMINO)PHENYL)METHYLIDENE)5OXO3(TRIFLUOROMETHYL)PYRAZOL1YL)BENZENESULFONAMIDE
4((4Z)4(4(DIETHYLAMINO)BENZYLIDENE)5OXO3(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)BENZENESULFONAMIDE
CCN(c1ccc(cc1)C=C1C(=O)N(N=C1C(F)(F)F)c1ccc(cc1)S(=O)(=O)N)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F
InChI=1SC21H21F3N4O3Sc1327(42)157514(6815)131819(21(2223)24)2628(20(18)29)1691117(121016)32(2530)31h513H34H212H3(H2253031)b1813
MFCD03271842
STK027701
ZINC000013940721
ZINC13940721
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