Vitas-M small molecule compound

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

Catalog ID
STK598814
SMILES C=CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OC(C)C)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 C26H25N3O2S2 MW 475.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S2/c1-5-13-28-25(30)23(33-26(28)32)15-19-16-29(20-9-7-6-8-10-20)27-24(19)22-12-11-21(14-18(22)4)31-17(2)3/h5-12,14-17H,1,13H2,2-4H3/b23-15-
InChIKey
GCZSYWVNJWDHSQ-HAHDFKILSA-N
Synonyms
956047-66-8
(5Z)5((3(2methyl4(propan2yloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(prop2en1yl)2thioxo13thiazolidin4one
(5Z)5((3(2METHYL4PROPAN2YLOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3allyl5((3(4isopropoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylene)2thioxothiazolidin4one
956047668
C=CCN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2C)OC(C)C)c2ccccc2)C1=O
CC1=C(C=CC(=C1)OC(C)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC=C)C4=CC=CC=C4
InChI=1SC26H25N3O2S2c15132825(30)23(3326(28)32)15191629(2097681020)2724(19)22121121(1418(22)4)3117(2)3h5121417H113H224H3b2315
MFCD03668075
ZINC000002431249
ZINC02431249
ZINC2431249

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Available files

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