Vitas-M small molecule compound
2-{(5E)-4-oxo-5-[4-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}pentanoic acid
Catalog ID
STK995166
SMILES CCCC(N1C(=S)S/C(=C/c2ccc(cc2)OCC=C)/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 C18H19NO4S2 MW 377.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4S2/c1-3-5-14(17(21)22)19-16(20)15(25-18(19)24)11-12-6-8-13(9-7-12)23-10-4-2/h4,6-9,11,14H,2-3,5,10H2,1H3,(H,21,22)/b15-11+InChIKey
CPFLMPVQFKYZFT-RVDMUPIBSA-NSynonyms
(Z)2(5(4(allyloxy)benzylidene)4oxo2thioxothiazolidin3yl)pentanoicacid
2((5E)4OXO5((4PROP2ENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANOICACID
2((5E)4oxo5(4(prop2en1yloxy)benzylidene)2thioxo13thiazolidin3yl)pentanoicacid
CCCC(C(=O)O)N1C(=O)C(=CC2=CC=C(C=C2)OCC=C)SC1=S
CCCC(N1C(=S)SC(=Cc2ccc(cc2)OCC=C)C1=O)C(=O)O
InChI=1SC18H19NO4S2c13514(17(21)22)1916(20)15(2518(19)24)11126813(9712)231042h4691114H23510H21H3(H2122)b1511+
MFCD18185116
ZINC000005965598
ZINC000005965670
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