Vitas-M small molecule compound
(4Z)-4-(aminomethylidene)-2-(1,3-benzothiazol-2-yl)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK097703
SMILES N/C=C/1\C(=O)N(N=C1C(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 C12H7F3N4OS MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H7F3N4OS/c13-12(14,15)9-6(5-16)10(20)19(18-9)11-17-7-3-1-2-4-8(7)21-11/h1-5H,16H2/b6-5-InChIKey
BHILJLHEMCRAML-WAYWQWQTSA-NSynonyms
(4Z)4(AMINOMETHYLIDENE)2(13BENZOTHIAZOL2YL)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)4(AMINOMETHYLIDENE)2(13BENZOTHIAZOL2YL)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(E)4(aminomethylene)1(benzo(d)thiazol2yl)3(trifluoromethyl)1Hpyrazol5(4H)one
C1=CC=C2C(=C1)N=C(S2)N3C(=O)C(=CN)C(=N3)C(F)(F)F
InChI=1SC12H7F3N4OSc1312(1415)96(516)10(20)19(189)1117731248(7)2111h15H16H2b65
MFCD02614409
NC=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2
STK097703
ZINC000013895855
ZINC13895855
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