Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-hydroxy-5-nitrophenyl)amino]ethylidene}-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK977126
SMILES C/C(=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)/Nc1cc(ccc1O)[N+](=O)[O-]
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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 C19H12F3N5O4S MW 463.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12F3N5O4S/c1-9(23-12-8-10(27(30)31)6-7-13(12)28)15-16(19(20,21)22)25-26(17(15)29)18-24-11-4-2-3-5-14(11)32-18/h2-8,23,28H,1H3/b15-9+InChIKey
NPEOAPLOQLMKRP-OQLLNIDSSA-NSynonyms
362589-73-9(4E)2(13benzothiazol2yl)4(1((2hydroxy5nitrophenyl)amino)ethylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4E)2(13BENZOTHIAZOL2YL)4(1(2HYDROXY5NITROANILINO)ETHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
2(13BENZOTHIAZOL2YL)4(1(2HYDROXY5NITROANILINO)ETHYLIDENE)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
362589739
CC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F)NC4=C(C=CC(=C4)(N+)(=O)(O))O
CC(=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)Nc1cc(ccc1O)(N+)(=O)(O)
InChI=1SC19H12F3N5O4Sc19(2312810(27(30)31)6713(12)28)1516(19(2021)22)2526(17(15)29)182411423514(11)3218h282328H1H3b159+
MFCD01811036
ZINC000100094391
ZINC100094391
Check stock
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