Vitas-M small molecule compound
[(5E)-5-{[2-(methoxycarbonyl)-1H-indol-3-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetic acid
Catalog ID
STK625129
SMILES COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)CC(=O)O)cccc2
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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 C16H12N2O5S2 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O5S2/c1-23-15(22)13-9(8-4-2-3-5-10(8)17-13)6-11-14(21)18(7-12(19)20)16(24)25-11/h2-6,17H,7H2,1H3,(H,19,20)/b11-6+InChIKey
LZRRNNQKQHFDJQ-IZZDOVSWSA-NSynonyms
((5E)5((2(methoxycarbonyl)1Hindol3yl)methylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
(E)2(5((2(methoxycarbonyl)1Hindol3yl)methylene)4oxo2thioxothiazolidin3yl)aceticacid
2((5E)5((2methoxycarbonyl1Hindol3yl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
COC(=O)c1(nH)c2c(c1C=C1SC(=S)N(C1=O)CC(=O)O)cccc2
COC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)N(C(=S)S3)CC(=O)O
InChI=1SC16H12N2O5S2c12315(22)139(8423510(8)1713)61114(21)18(712(19)20)16(24)2511h2617H7H21H3(H1920)b116+
MFCD09854242
ZINC000013693501
ZINC13693501
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