Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-[1-(biphenyl-2-ylamino)ethylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK082491
SMILES C/C(=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/Nc1ccccc1c1ccccc1
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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 C25H17F3N4OS MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17F3N4OS/c1-15(29-18-12-6-5-11-17(18)16-9-3-2-4-10-16)21-22(25(26,27)28)31-32(23(21)33)24-30-19-13-7-8-14-20(19)34-24/h2-14,29H,1H3/b21-15+InChIKey
ITCXOVNITXGFER-RCCKNPSSSA-NSynonyms
406914-96-3(4E)2(13benzothiazol2yl)4(1(2phenylanilino)ethylidene)5(trifluoromethyl)pyrazol3one
(4E)2(13BENZOTHIAZOL2YL)4(1(BIPHENYL2YLAMINO)ETHYLIDENE)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
(E)4(1((11biphenyl)2ylamino)ethylidene)1(benzo(d)thiazol2yl)3(trifluoromethyl)1Hpyrazol5(4H)one
406914963
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NC4=CC=CC=C4C5=CC=CC=C5
CC(=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)Nc1ccccc1c1ccccc1
InChI=1SC25H17F3N4OSc115(291812651117(18)1693241016)2122(25(2627)28)3132(23(21)33)24301913781420(19)3424h21429H1H3b2115+
MFCD01960550
STK082491
ZINC000100094354
ZINC09311134
ZINC100094354
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