Vitas-M small molecule compound

(2Z)-N-(1,3-benzothiazol-2-yl)-3-(4-phenylpiperazin-1-yl)-2-(trifluoroacetyl)but-2-enehydrazide

Catalog ID
STK022647
SMILES O=C(/C(=C(\N1CCN(CC1)c1ccccc1)/C)/C(=O)C(F)(F)F)N(c1nc2c(s1)cccc2)N

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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 C23H22F3N5O2S MW 489.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22F3N5O2S/c1-15(29-11-13-30(14-12-29)16-7-3-2-4-8-16)19(20(32)23(24,25)26)21(33)31(27)22-28-17-9-5-6-10-18(17)34-22/h2-10H,11-14,27H2,1H3/b19-15-
InChIKey
UUMXSKZCMZHFIQ-CYVLTUHYSA-N
Synonyms

(2Z)N(13BENZOTHIAZOL2YL)3(4PHENYLPIPERAZIN1YL)2(TRIFLUOROACETYL)BUT2ENEHYDRAZIDE
(2Z)NAMINONBENZOTHIAZOL2YL3(4PHENYLPIPERAZINYL)2(222TRIFLUOROACETYL)BUT2ENAMIDE
(Z)N(13BENZOTHIAZOL2YL)3(4PHENYLPIPERAZIN1YL)2(222TRIFLUOROACETYL)BUT2ENEHYDRAZIDE
CC(=C(C(=O)C(F)(F)F)C(=O)N(C1=NC2=CC=CC=C2S1)N)N3CCN(CC3)C4=CC=CC=C4
InChI=1SC23H22F3N5O2Sc115(29111330(141229)167324816)19(20(32)23(2425)26)21(33)31(27)2228179561018(17)3422h210H111427H21H3b1915
MFCD03488839
N(benzo(d)thiazol2yl)3(4phenylpiperazin1yl)2(222trifluoroacetyl)but2enehydrazide
O=C(C(=C(N1CCN(CC1)c1ccccc1)C)C(=O)C(F)(F)F)N(c1nc2c(s1)cccc2)N
STK022647
ZINC000100428165
ZINC02346414
ZINC100428165

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.