Vitas-M small molecule compound
(5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702353
SMILES COc1ccc(cc1OC)CCN1C(=S)S/C(=C\c2cn(nc2c2cc(C)ccc2C)c2ccccc2)/C1=O
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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 C31H29N3O3S2 MW 555.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O3S2/c1-20-10-11-21(2)25(16-20)29-23(19-34(32-29)24-8-6-5-7-9-24)18-28-30(35)33(31(38)39-28)15-14-22-12-13-26(36-3)27(17-22)37-4/h5-13,16-19H,14-15H2,1-4H3/b28-18-InChIKey
UOIPOYQLYBRVBP-VEILYXNESA-NSynonyms
(5Z)3(2(34dimethoxyphenyl)ethyl)5((3(25dimethylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(2(34DIMETHOXYPHENYL)ETHYL)5((3(25DIMETHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(34dimethoxyphenethyl)5((3(25dimethylphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
CC1=CC(=C(C=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC4=CC(=C(C=C4)OC)OC)C5=CC=CC=C5
COc1ccc(cc1OC)CCN1C(=S)SC(=Cc2cn(nc2c2cc(C)ccc2C)c2ccccc2)C1=O
InChI=1SC31H29N3O3S2c120101121(2)25(1620)2923(1934(3229)248657924)182830(35)33(31(38)3928)151422121326(363)27(1722)374h5131619H1415H214H3b2818
MFCD02995304
ZINC000001872900
ZINC01872900
ZINC1872900
Check stock
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Check stock on Vitas-MAvailable files
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