Vitas-M small molecule compound

2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioic acid

Catalog ID
STL019098
SMILES OC(=O)CCC(N1C(=S)S/C(=C\c2ccccc2)/C1=O)C(=O)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 C15H13NO5S2 MW 351.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO5S2/c17-12(18)7-6-10(14(20)21)16-13(19)11(23-15(16)22)8-9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H,17,18)(H,20,21)/b11-8-
InChIKey
DTPSNZKCDHPUJR-FLIBITNWSA-N
Synonyms
16942-89-5
(Z)2(5benzylidene4oxo2thioxothiazolidin3yl)pentanedioicacid
16942895
2((5Z)5BENZYLIDENE4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANEDIOICACID
2((5Z)5benzylidene4oxo2thioxo13thiazolidin3yl)pentanedioicacid
2(5BENZYLIDENE4OXO2THIOXOTHIAZOLIDIN3YL)PENTANEDIOICACID
C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C(CCC(=O)O)C(=O)O
InChI=1SC15H13NO5S2c1712(18)7610(14(20)21)1613(19)11(2315(16)22)89421359h15810H67H2(H1718)(H2021)b118
MFCD00395878
OC(=O)CCC(N1C(=S)SC(=Cc2ccccc2)C1=O)C(=O)O
ZINC000001908115
ZINC000001908120

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Available files

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