Vitas-M small molecule compound

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

Catalog ID
STK143022
SMILES Fc1cccc(c1)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 C18H10F4N4OS MW 406.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H10F4N4OS/c19-10-4-3-5-11(8-10)23-9-12-15(18(20,21)22)25-26(16(12)27)17-24-13-6-1-2-7-14(13)28-17/h1-9,23H/b12-9-
InChIKey
UMTLWDHWXVSACI-XFXZXTDPSA-N
Synonyms

(4Z)2(13BENZOTHIAZOL2YL)4(((3FLUOROPHENYL)AMINO)METHYLIDENE)5(TRIFLUOROMETHYL)24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)4((3FLUOROANILINO)METHYLIDENE)5(TRIFLUOROMETHYL)PYRAZOL3ONE
(E)1(benzo(d)thiazol2yl)4(((3fluorophenyl)amino)methylene)3(trifluoromethyl)1Hpyrazol5(4H)one
C1=CC=C2C(=C1)N=C(S2)N3C(=O)C(=CNC4=CC(=CC=C4)F)C(=N3)C(F)(F)F
Fc1cccc(c1)NC=C1C(=O)N(N=C1C(F)(F)F)c1nc2c(s1)cccc2
InChI=1SC18H10F4N4OSc191043511(810)2391215(18(2021)22)2526(16(12)27)172413612714(13)2817h1923Hb129
MFCD02614402
ZINC000100418492
ZINC100418492

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Available files

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