Vitas-M small molecule compound

(2Z)-2-cyano-N-(2,6-dimethylphenyl)-2-[5-(4-methoxybenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]ethanamide

Catalog ID
STK740487
SMILES N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)/C(=O)Nc1c(C)cccc1C

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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 C28H25N3O3S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O3S/c1-18-8-7-9-19(2)25(18)30-26(32)23(17-29)28-31(21-10-5-4-6-11-21)27(33)24(35-28)16-20-12-14-22(34-3)15-13-20/h4-15,24H,16H2,1-3H3,(H,30,32)/b28-23-
InChIKey
QCQYGUQCUBDEHW-NFFVHWSESA-N
Synonyms

(2Z)2CYANON(26DIMETHYLPHENYL)2(5((4METHOXYPHENYL)METHYL)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)ACETAMIDE
(2Z)2cyanoN(26dimethylphenyl)2(5(4methoxybenzyl)4oxo3phenyl13thiazolidin2ylidene)ethanamide
(E)2cyanoN(26dimethylphenyl)2(5(4methoxybenzyl)4oxo3phenylthiazolidin2ylidene)acetamide
CC1=C(C(=CC=C1)C)NC(=O)C(=C2N(C(=O)C(S2)CC3=CC=C(C=C3)OC)C4=CC=CC=C4)C#N
InChI=1SC28H25N3O3Sc11887919(2)25(18)3026(32)23(1729)2831(21105461121)27(33)24(3528)1620121422(343)151320h41524H16H213H3(H3032)b2823
MFCD06438326
N#CC(=C1SC(C(=O)N1c1ccccc1)Cc1ccc(cc1)OC)C(=O)Nc1c(C)cccc1C
N(26DIMETHYLPHENYL)2CYANO2(5((4METHOXYPHENYL)METHYL)4OXO3PHENYL(13THIAZOLIDIN2YLIDENE))ACETAMIDE
ZINC000002229054
ZINC000002229057

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Available files

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