Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-[(cyclopentylamino)methylidene]-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL004813
SMILES O=C1N(N=C(/C/1=C/NC1CCCC1)C(F)(F)F)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 C17H15F3N4OS MW 380.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N4OS/c18-17(19,20)14-11(9-21-10-5-1-2-6-10)15(25)24(23-14)16-22-12-7-3-4-8-13(12)26-16/h3-4,7-10,21H,1-2,5-6H2/b11-9-InChIKey
HPTGBBAUTCMNRI-LUAWRHEFSA-NSynonyms
(4Z)2(13benzothiazol2yl)4((cyclopentylamino)methylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
(4Z)2(13BENZOTHIAZOL2YL)4((CYCLOPENTYLAMINO)METHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(Z)1(benzo(d)thiazol2yl)4((cyclopentylamino)methylene)3(trifluoromethyl)1Hpyrazol5(4H)one
C1CCC(C1)NC=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F
InChI=1SC17H15F3N4OSc1817(1920)1411(92110512610)15(25)24(2314)162212734813(12)2616h3471021H1256H2b119
MFCD04162978
O=C1N(N=C(C1=CNC1CCCC1)C(F)(F)F)c1nc2c(s1)cccc2
ZINC000101104573
ZINC04673636
ZINC101104573
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