Vitas-M small molecule compound

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

Catalog ID
STK740596
SMILES CNC(=O)/C(=C/1\SC(C(=O)N1c1ccccc1C)Cc1cc(Cl)ccc1Cl)/C#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 C21H17Cl2N3O2S MW 446.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3O2S/c1-12-5-3-4-6-17(12)26-20(28)18(10-13-9-14(22)7-8-16(13)23)29-21(26)15(11-24)19(27)25-2/h3-9,18H,10H2,1-2H3,(H,25,27)/b21-15-
InChIKey
FMYUUUXSCDNRAZ-QNGOZBTKSA-N
Synonyms
842968-99-4
(2Z)2CYANO2(5((25DICHLOROPHENYL)METHYL)3(2METHYLPHENYL)4OXO13THIAZOLIDIN2YLIDENE)NMETHYLACETAMIDE
(2Z)2cyano2(5(25dichlorobenzyl)3(2methylphenyl)4oxo13thiazolidin2ylidene)Nmethylethanamide
(Z)2cyano2(5(25dichlorobenzyl)4oxo3(otolyl)thiazolidin2ylidene)Nmethylacetamide
2(5((25DICHLOROPHENYL)METHYL)3(2METHYLPHENYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANONMETHYLACETAMIDE
842968994
CC1=CC=CC=C1N2C(=O)C(SC2=C(C#N)C(=O)NC)CC3=C(C=CC(=C3)Cl)Cl
CNC(=O)C(=C1SC(C(=O)N1c1ccccc1C)Cc1cc(Cl)ccc1Cl)C#N
InChI=1SC21H17Cl2N3O2Sc112534617(12)2620(28)18(1013914(22)7816(13)23)2921(26)15(1124)19(27)252h3918H10H212H3(H2527)b2115
MFCD04012680
ZINC000002409135
ZINC000002409137

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Available files

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