Vitas-M small molecule compound

4-[(5E)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoic acid

Catalog ID
STK801322
SMILES OC(=O)CCCN1C(=S)S/C(=C/c2ccc(cc2)C)/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 C15H15NO3S2 MW 321.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO3S2/c1-10-4-6-11(7-5-10)9-12-14(19)16(15(20)21-12)8-2-3-13(17)18/h4-7,9H,2-3,8H2,1H3,(H,17,18)/b12-9+
InChIKey
JRISRDBHOMHYBY-FMIVXFBMSA-N
Synonyms

(Z)4(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)butanoicacid
4((5E)5((4methylphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)butanoicacid
4((5E)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
4(5(4METHYLBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)BUTYRICACID
CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)O
InChI=1SC15H15NO3S2c1104611(7510)91214(19)16(15(20)2112)82313(17)18h479H238H21H3(H1718)b129+
MFCD00710938
OC(=O)CCCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
ZINC000000966901
ZINC966901

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Available files

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