Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[2-(1H-imidazol-4-yl)ethyl]amino}ethylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK207402
SMILES C/C(=C\1/C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/NCCc1c[nH]cn1
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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 C18H15F3N6OS MW 420.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N6OS/c1-10(23-7-6-11-8-22-9-24-11)14-15(18(19,20)21)26-27(16(14)28)17-25-12-4-2-3-5-13(12)29-17/h2-5,8-9,23H,6-7H2,1H3,(H,22,24)/b14-10-InChIKey
OGMPHKUPJAMQKJ-UVTDQMKNSA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((2(1Himidazol4yl)ethyl)amino)ethylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4(1(2(1Himidazol5yl)ethylamino)ethylidene)5(trifluoromethyl)pyrazol3one
1BENZOTHIAZOL2YL4(((2IMIDAZOL4YLETHYL)AMINO)ETHYLIDENE)3(TRIFLUOROMETHYL)12DIAZOLIN5ONE
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NCCC4=CN=CN4
CC(=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)NCCc1c(nH)cn1
InChI=1SC18H15F3N6OSc110(23761182292411)1415(18(1920)21)2627(16(14)28)172512423513(12)2917h258923H67H21H3(H2224)b1410
MFCD06754528
ZINC000008775673
ZINC8775673
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