Vitas-M small molecule compound

3-[(5Z)-5-{[3-(2,5-dimethylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid

Catalog ID
STK702351
SMILES OC(=O)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 C24H21N3O3S2 MW 463.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O3S2/c1-15-8-9-16(2)19(12-15)22-17(14-27(25-22)18-6-4-3-5-7-18)13-20-23(30)26(24(31)32-20)11-10-21(28)29/h3-9,12-14H,10-11H2,1-2H3,(H,28,29)/b20-13-
InChIKey
XORJVFUSEWASLO-MOSHPQCFSA-N
Synonyms

(Z)3(5((3(25dimethylphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5Z)5((3(25dimethylphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((3(25DIMETHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
CC1=CC(=C(C=C1)C)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCC(=O)O)C4=CC=CC=C4
InChI=1SC24H21N3O3S2c1158916(2)19(1215)2217(1427(2522)186435718)132023(30)26(24(31)3220)111021(28)29h391214H1011H212H3(H2829)b2013
MFCD02988846
OC(=O)CCN1C(=S)SC(=Cc2cn(nc2c2cc(C)ccc2C)c2ccccc2)C1=O
ZINC000013799996
ZINC13799996

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Available files

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