Vitas-M small molecule compound
{(5Z)-5-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STL477276
SMILES C=CCOc1c(Br)cc(cc1OC)/C=C/1\SC(=S)N(C1=O)CC(=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 C16H14BrNO5S2 MW 444.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO5S2/c1-3-4-23-14-10(17)5-9(6-11(14)22-2)7-12-15(21)18(8-13(19)20)16(24)25-12/h3,5-7H,1,4,8H2,2H3,(H,19,20)/b12-7-InChIKey
BKRRMMPORPNWFG-GHXNOFRVSA-NSynonyms
((5Z)5(3bromo5methoxy4(prop2en1yloxy)benzylidene)4oxo2thioxo13thiazolidin3yl)aceticacid
2((5Z)5((3bromo5methoxy4prop2enoxyphenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C=CCOc1c(Br)cc(cc1OC)C=C1SC(=S)N(C1=O)CC(=O)O
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)O)Br)OCC=C
InChI=1SC16H14BrNO5S2c134231410(17)59(611(14)222)71215(21)18(813(19)20)16(24)2512h357H148H22H3(H1920)b127
MFCD30713142
ZINC000002799553
ZINC2799553
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