Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-(1-{[2-(trifluoromethoxy)phenyl]amino}ethylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK261968
SMILES CC1=NN(C(=O)/C/1=C(\Nc1ccccc1OC(F)(F)F)/C)c1nc2c(s1)cccc2
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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 C20H15F3N4O2S MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N4O2S/c1-11(24-13-7-3-5-9-15(13)29-20(21,22)23)17-12(2)26-27(18(17)28)19-25-14-8-4-6-10-16(14)30-19/h3-10,24H,1-2H3/b17-11-InChIKey
UHABJYDDFKLMEZ-BOPFTXTBSA-NSynonyms
(4Z)2(13benzothiazol2yl)5methyl4(1((2(trifluoromethoxy)phenyl)amino)ethylidene)24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)5methyl4(1(2(trifluoromethoxy)anilino)ethylidene)pyrazol3one
(Z)1(benzo(d)thiazol2yl)3methyl4(1((2(trifluoromethoxy)phenyl)amino)ethylidene)1Hpyrazol5(4H)one
1BENZOTHIAZOL2YL3METHYL4(((2(TRIFLUOROMETHOXY)PHENYL)AMINO)ETHYLIDENE)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=C(C)NC2=CC=CC=C2OC(F)(F)F)C3=NC4=CC=CC=C4S3
CC1=NN(C(=O)C1=C(Nc1ccccc1OC(F)(F)F)C)c1nc2c(s1)cccc2
InChI=1SC20H15F3N4O2Sc111(2413735915(13)2920(2122)23)1712(2)2627(18(17)28)1925148461016(14)3019h31024H12H3b1711
MFCD07597026
ZINC000100423131
ZINC100423131
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