Vitas-M small molecule compound

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

Catalog ID
STK702623
SMILES CC(Oc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C1CCS(=O)(=O)C1)c1ccccc1)C

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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 C26H25N3O4S3 MW 539.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S3/c1-17(2)33-22-10-8-18(9-11-22)24-19(15-28(27-24)20-6-4-3-5-7-20)14-23-25(30)29(26(34)35-23)21-12-13-36(31,32)16-21/h3-11,14-15,17,21H,12-13,16H2,1-2H3/b23-14-
InChIKey
SVGPLFPEAINDGO-UCQKPKSFSA-N
Synonyms

(5Z)3(11dioxidotetrahydrothiophen3yl)5((1phenyl3(4(propan2yloxy)phenyl)1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(11DIOXOTHIOLAN3YL)5((1PHENYL3(4PROPAN2YLOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(11dioxidotetrahydrothiophen3yl)5((3(4isopropoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
CC(C)OC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)C5=CC=CC=C5
CC(Oc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1)c1ccccc1)C
InChI=1SC26H25N3O4S3c117(2)332210818(91122)2419(1528(2724)206435720)142325(30)29(26(34)3523)21121336(3132)1621h31114151721H121316H212H3b2314
MFCD02990000
ZINC000100770606
ZINC000100770610

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Available files

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