Vitas-M small molecule compound

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

Catalog ID
STK823506
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)C)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 C30H27N3O2S2 MW 525.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O2S2/c1-4-16-35-26-15-12-22(17-21(26)3)28-23(19-32(31-28)24-8-6-5-7-9-24)18-27-29(34)33(30(36)37-27)25-13-10-20(2)11-14-25/h5-15,17-19H,4,16H2,1-3H3/b27-18-
InChIKey
JLRNPQCDXGBGGJ-IMRQLAEWSA-N
Synonyms

(5Z)3(4methylphenyl)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(4METHYLPHENYL)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)C)C5=CC=CC=C5)C
CCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)c1ccc(cc1)C)c1ccccc1
InChI=1SC30H27N3O2S2c14163526151222(1721(26)3)2823(1932(3128)248657924)182729(34)33(30(36)3727)25131020(2)111425h5151719H416H213H3b2718
MFCD03464007
ZINC000027019876
ZINC27019876

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Available files

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