Vitas-M small molecule compound
(5Z)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-5-[(3-{4-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK798305
SMILES S=C1S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)/C(=O)N1C1CCS(=O)(=O)C1
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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 C30H24FN3O4S3 MW 605.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24FN3O4S3/c31-26-9-5-4-6-21(26)18-38-25-12-10-20(11-13-25)28-22(17-33(32-28)23-7-2-1-3-8-23)16-27-29(35)34(30(39)40-27)24-14-15-41(36,37)19-24/h1-13,16-17,24H,14-15,18-19H2/b27-16-InChIKey
RXJSJHGQQMIZHE-YUMHPJSZSA-NSynonyms
(5Z)3(11dioxidotetrahydrothiophen3yl)5((3(4((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(11DIOXOTHIOLAN3YL)5((3(4((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
C1CS(=O)(=O)CC1N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5F)C6=CC=CC=C6)SC2=S
InChI=1SC30H24FN3O4S3c3126954621(26)183825121020(111325)2822(1733(3228)237213823)162729(35)34(30(39)4027)24141541(3637)1924h113161724H14151819H2b2716
MFCD03417632
S=C1SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2F)c2ccccc2)C(=O)N1C1CCS(=O)(=O)C1
ZINC000100838540
ZINC000100838541
Check stock
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Check stock on Vitas-MAvailable files
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