Vitas-M small molecule compound

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

Catalog ID
STK881164
SMILES CCSc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCC(=O)O)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 C25H23N3O3S3 MW 509.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3S3/c1-2-33-20-12-10-17(11-13-20)23-18(16-28(26-23)19-7-4-3-5-8-19)15-21-24(31)27(25(32)34-21)14-6-9-22(29)30/h3-5,7-8,10-13,15-16H,2,6,9,14H2,1H3,(H,29,30)/b21-15-
InChIKey
YSGSRNUFVLDXFL-QNGOZBTKSA-N
Synonyms
1009434-93-8
(Z)4(5((3(4(ethylthio)phenyl)1phenyl1Hpyrazol4yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
1009434938
4((5Z)5((3(4(ethylsulfanyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4((5Z)5((3(4ETHYLSULFANYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
CCSC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CCCC(=O)O)C4=CC=CC=C4
CCSc1ccc(cc1)c1nn(cc1C=C1SC(=S)N(C1=O)CCCC(=O)O)c1ccccc1
InChI=1SC25H23N3O3S3c123320121017(111320)2318(1628(2623)197435819)152124(31)27(25(32)3421)146922(29)30h357810131516H26914H21H3(H2930)b2115
MFCD03692291
ZINC000002253943
ZINC2253943

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Available files

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