Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-(1-{[3-(1H-imidazol-1-yl)propyl]amino}ethylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK868329
SMILES C/C(=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/NCCCn1cncc1
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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 C19H17F3N6OS MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F3N6OS/c1-12(24-7-4-9-27-10-8-23-11-27)15-16(19(20,21)22)26-28(17(15)29)18-25-13-5-2-3-6-14(13)30-18/h2-3,5-6,8,10-11,24H,4,7,9H2,1H3/b15-12+InChIKey
UIDOGKACTUAUDT-NTCAYCPXSA-NSynonyms
362589-71-7(4E)1(13BENZOTHIAZOL2YL)4(1((3(1HIMIDAZOL1YL)PROPYL)AMINO)ETHYLIDENE)3(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5ONE
(4E)2(13benzothiazol2yl)4(1((3(1Himidazol1yl)propyl)amino)ethylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4E)2(13BENZOTHIAZOL2YL)4(1(3IMIDAZOL1YLPROPYLAMINO)ETHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(E)4(1((3(1Himidazol1yl)propyl)amino)ethylidene)1(benzo(d)thiazol2yl)3(trifluoromethyl)1Hpyrazol5(4H)one
362589717
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NCCCN4C=CN=C4
CC(=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)NCCCn1cncc1
InChI=1SC19H17F3N6OSc112(2474927108231127)1516(19(2021)22)2628(17(15)29)182513523614(13)3018h23568101124H479H21H3b1512+
MFCD01466161
ZINC000018091192
ZINC18091192
Check stock
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Check stock on Vitas-MAvailable files
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