Vitas-M small molecule compound

(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(dimethylamino)methylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STL023649
SMILES CN(/C=C/1\C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)C

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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 C14H11F3N4OS MW 340.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11F3N4OS/c1-20(2)7-8-11(14(15,16)17)19-21(12(8)22)13-18-9-5-3-4-6-10(9)23-13/h3-7H,1-2H3/b8-7-
InChIKey
CJZBLACDLAMRMR-FPLPWBNLSA-N
Synonyms
336177-19-6
(4Z)2(13benzothiazol2yl)4((dimethylamino)methylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4Z)2(13BENZOTHIAZOL2YL)4(DIMETHYLAMINOMETHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(E)1(benzo(d)thiazol2yl)4((dimethylamino)methylene)3(trifluoromethyl)1Hpyrazol5(4H)one
1BENZOTHIAZOL2YL4((DIMETHYLAMINO)METHYLENE)3(TRIFLUOROMETHYL)12DIAZOLIN5ONE
336177196
CN(C)C=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)C(F)(F)F
CN(C=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2)C
InChI=1SC14H11F3N4OSc120(2)7811(14(1516)17)1921(12(8)22)13189534610(9)2313h37H12H3b87
MFCD01210543
ZINC000018192785
ZINC18192785

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Available files

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