Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-{1-[(diphenylmethyl)amino]ethylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK741747
SMILES C/C(=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/NC(c1ccccc1)c1ccccc1
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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 C26H19F3N4OS MW 492.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19F3N4OS/c1-16(30-22(17-10-4-2-5-11-17)18-12-6-3-7-13-18)21-23(26(27,28)29)32-33(24(21)34)25-31-19-14-8-9-15-20(19)35-25/h2-15,22,30H,1H3/b21-16+InChIKey
DYFGNUSHWHZEHF-LTGZKZEYSA-NSynonyms
(4E)2(13benzothiazol2yl)4(1((diphenylmethyl)amino)ethylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4E)4(1(BENZHYDRYLAMINO)ETHYLIDENE)2(13BENZOTHIAZOL2YL)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(E)4(1(benzhydrylamino)ethylidene)1(benzo(d)thiazol2yl)3(trifluoromethyl)1Hpyrazol5(4H)one
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NC(C4=CC=CC=C4)C5=CC=CC=C5
CC(=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)NC(c1ccccc1)c1ccccc1
InChI=1SC26H19F3N4OSc116(3022(17104251117)18126371318)2123(26(2728)29)3233(24(21)34)25311914891520(19)3525h2152230H1H3b2116+
MFCD01811039
ZINC000008694712
ZINC08694712
ZINC8694712
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