Vitas-M small molecule compound
3-methyl-2-{(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoic acid
Catalog ID
STK995283
SMILES CC(C(N1C(=S)S/C(=C/c2cccn2C)/C1=O)C(=O)O)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 C14H16N2O3S2 MW 324.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S2/c1-8(2)11(13(18)19)16-12(17)10(21-14(16)20)7-9-5-4-6-15(9)3/h4-8,11H,1-3H3,(H,18,19)/b10-7+InChIKey
SENGJYWBFIKNOC-JXMROGBWSA-NSynonyms
(Z)3methyl2(5((1methyl1Hpyrrol2yl)methylene)4oxo2thioxothiazolidin3yl)butanoicacid
3methyl2((5E)5((1methyl1Hpyrrol2yl)methylidene)4oxo2thioxo13thiazolidin3yl)butanoicacid
3METHYL2((5E)5((1METHYLPYRROL2YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOICACID
CC(C(N1C(=S)SC(=Cc2cccn2C)C1=O)C(=O)O)C
CC(C)C(C(=O)O)N1C(=O)C(=CC2=CC=CN2C)SC1=S
InChI=1SC14H16N2O3S2c18(2)11(13(18)19)1612(17)10(2114(16)20)7954615(9)3h4811H13H3(H1819)b107+
MFCD18185197
ZINC000005690107
ZINC000005690110
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