Vitas-M small molecule compound
(5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[3-(3-fluoro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK880869
SMILES CCCOc1ccc(cc1F)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)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 C32H30FN3O4S2 MW 603.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30FN3O4S2/c1-4-16-40-26-13-11-22(18-25(26)33)30-23(20-36(34-30)24-8-6-5-7-9-24)19-29-31(37)35(32(41)42-29)15-14-21-10-12-27(38-2)28(17-21)39-3/h5-13,17-20H,4,14-16H2,1-3H3/b29-19-InChIKey
LJJMEZHXLXDQTN-CEUNXORHSA-NSynonyms
(5Z)3(2(34dimethoxyphenyl)ethyl)5((3(3fluoro4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(2(34DIMETHOXYPHENYL)ETHYL)5((3(3FLUORO4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
3(34DIMETHOXYPHENETHYL)5((3(3FLUORO4PROPOXYPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)2THIOXOTHIAZOLIDIN4ONE
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5)F
CCCOc1ccc(cc1F)c1nn(cc1C=C1SC(=S)N(C1=O)CCc1ccc(c(c1)OC)OC)c1ccccc1
InChI=1SC32H30FN3O4S2c14164026131122(1825(26)33)3023(2036(3430)248657924)192931(37)35(32(41)4229)151421101227(382)28(1721)393h5131720H41416H213H3b2919
MFCD03506527
ZINC000100871110
ZINC100871110
Check stock
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Check stock on Vitas-MAvailable files
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