Vitas-M small molecule compound

(2Z)-2-[3-(4-bromophenyl)-5-(4-ethylbenzyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyano-N-methylethanamide

Catalog ID
STK740297
SMILES N#C/C(=C\1/SC(C(=O)N1c1ccc(cc1)Br)Cc1ccc(cc1)CC)/C(=O)NC

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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 C22H20BrN3O2S MW 470.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O2S/c1-3-14-4-6-15(7-5-14)12-19-21(28)26(17-10-8-16(23)9-11-17)22(29-19)18(13-24)20(27)25-2/h4-11,19H,3,12H2,1-2H3,(H,25,27)/b22-18-
InChIKey
BIQQWYJGESHKBV-PYCFMQQDSA-N
Synonyms
843625-97-8
(2Z)2(3(4BROMOPHENYL)5((4ETHYLPHENYL)METHYL)4OXO13THIAZOLIDIN2YLIDENE)2CYANONMETHYLACETAMIDE
(2Z)2(3(4bromophenyl)5(4ethylbenzyl)4oxo13thiazolidin2ylidene)2cyanoNmethylethanamide
(Z)2(3(4bromophenyl)5(4ethylbenzyl)4oxothiazolidin2ylidene)2cyanoNmethylacetamide
2(3(4BROMOPHENYL)5((4ETHYLPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANONMETHYLACETAMIDE
843625978
CCC1=CC=C(C=C1)CC2C(=O)N(C(=C(C#N)C(=O)NC)S2)C3=CC=C(C=C3)Br
InChI=1SC22H20BrN3O2Sc13144615(7514)121921(28)26(1710816(23)91117)22(2919)18(1324)20(27)252h41119H312H212H3(H2527)b2218
MFCD04015656
N#CC(=C1SC(C(=O)N1c1ccc(cc1)Br)Cc1ccc(cc1)CC)C(=O)NC
ZINC000002438485
ZINC000002438489

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Available files

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