Vitas-M small molecule compound

(5Z)-5-({3-[4-(ethylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK881250
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1

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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 C29H25N3OS3 MW 527.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3OS3/c1-2-35-25-15-13-22(14-16-25)27-23(20-32(30-27)24-11-7-4-8-12-24)19-26-28(33)31(29(34)36-26)18-17-21-9-5-3-6-10-21/h3-16,19-20H,2,17-18H2,1H3/b26-19-
InChIKey
SGHLHIXWVXSFLH-XHPQRKPJSA-N
Synonyms
1009434-88-1
(5Z)5((3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(2phenylethyl)2thioxo13thiazolidin4one
(5Z)5((3(4ethylsulfanylphenyl)1phenylpyrazol4yl)methylidene)3(2phenylethyl)2sulfanylidene13thiazolidin4one
(5Z)5((3(4ETHYLSULFANYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PHENETHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)methylene)3phenethyl2thioxothiazolidin4one
1009434881
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)C5=CC=CC=C5
CCSc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccccc1)c1ccccc1
InChI=1SC29H25N3OS3c123525151322(141625)2723(2032(3027)24117481224)192628(33)31(29(34)3626)18172195361021h3161920H21718H21H3b2619
MFCD03692071
ZINC000101017524
ZINC101017524

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Available files

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