Vitas-M small molecule compound

ethyl (2Z)-[5-(4-chlorobenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene](cyano)ethanoate

Catalog ID
STK740648
SMILES CCOC(=O)/C(=C/1\SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)Cl)/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 C21H17ClN2O3S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3S/c1-2-27-21(26)17(13-23)20-24(16-6-4-3-5-7-16)19(25)18(28-20)12-14-8-10-15(22)11-9-14/h3-11,18H,2,12H2,1H3/b20-17-
InChIKey
MMDYEECRCQOVCJ-JZJYNLBNSA-N
Synonyms
487034-24-2
(Z)ethyl2(5(4chlorobenzyl)4oxo3phenylthiazolidin2ylidene)2cyanoacetate
487034242
CCOC(=O)C(=C1N(C(=O)C(S1)CC2=CC=C(C=C2)Cl)C3=CC=CC=C3)C#N
CCOC(=O)C(=C1SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)Cl)C#N
ethyl(2Z)(5(4chlorobenzyl)4oxo3phenyl13thiazolidin2ylidene)(cyano)ethanoate
ETHYL(2Z)2(5((4CHLOROPHENYL)METHYL)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)2CYANOACETATE
ETHYL2(5((4CHLOROPHENYL)METHYL)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))2CYANOACETATE
InChI=1SC21H17ClN2O3Sc122721(26)17(1323)2024(166435716)19(25)18(2820)121481015(22)11914h31118H212H21H3b2017
MFCD03287184
ZINC000013553050
ZINC000013553051

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Available files

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