Vitas-M small molecule compound
(5E)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-({3-[4-(ethylsulfonyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK882036
SMILES CCS(=O)(=O)c1ccc(cc1)c1nn(cc1/C=C\1/SC(=S)N(C1=O)C1CCS(=O)(=O)C1)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 C25H23N3O5S4 MW 573.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S4/c1-2-37(32,33)21-10-8-17(9-11-21)23-18(15-27(26-23)19-6-4-3-5-7-19)14-22-24(29)28(25(34)35-22)20-12-13-36(30,31)16-20/h3-11,14-15,20H,2,12-13,16H2,1H3/b22-14+InChIKey
SCHCQYLRTORWTI-HYARGMPZSA-NSynonyms
(5E)3(11dioxidotetrahydrothiophen3yl)5((3(4(ethylsulfonyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5E)3(11dioxothiolan3yl)5((3(4ethylsulfonylphenyl)1phenylpyrazol4yl)methylidene)2sulfanylidene13thiazolidin4one
CCS(=O)(=O)C1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C4CCS(=O)(=O)C4)C5=CC=CC=C5
CCS(=O)(=O)c1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)C1CCS(=O)(=O)C1)c1ccccc1
InChI=1SC25H23N3O5S4c1237(3233)2110817(91121)2318(1527(2623)196435719)142224(29)28(25(34)3522)20121336(3031)1620h311141520H2121316H21H3b2214+
MFCD06645937
ZINC000097946797
ZINC000097946798
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