Vitas-M small molecule compound

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

Catalog ID
STK814638
SMILES CC(COc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C)c1ccccc1)C

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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 C25H25N3O2S2 MW 463.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O2S2/c1-16(2)15-30-21-11-10-18(12-17(21)3)23-19(13-22-24(29)27(4)25(31)32-22)14-28(26-23)20-8-6-5-7-9-20/h5-14,16H,15H2,1-4H3/b22-13-
InChIKey
OCFJQGLFDOQBRF-XKZIYDEJSA-N
Synonyms

(5Z)3methyl5((3(3methyl4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)3METHYL5((3(3METHYL4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5((3(4isobutoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)3methyl2thioxothiazolidin4one
3METHYL5((3(3METHYL4(2METHYLPROPOXY)PHENYL)1PHENYLPYRAZOL4YL)METHYLENE)2THIOXO13THIAZOLIDIN4ONE
5((3(4ISOBUTOXY3METHYLPHENYL)1PHENYL1HPYRAZOL4YL)METHYLENE)3METHYL2THIOXOTHIAZOLIDIN4ONE
CC(COc1ccc(cc1C)c1nn(cc1C=C1SC(=S)N(C1=O)C)c1ccccc1)C
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)C)C4=CC=CC=C4)OCC(C)C
InChI=1SC25H25N3O2S2c116(2)153021111018(1217(21)3)2319(132224(29)27(4)25(31)3222)1428(2623)208657920h51416H15H214H3b2213
MFCD03666960
ZINC000002377616
ZINC02377616
ZINC2377616

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Available files

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