Vitas-M small molecule compound
6-{(5Z)-5-[5-bromo-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}hexanoic acid
Catalog ID
STK702101
SMILES C=CCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCCCCC(=O)O)/c2c1ccc(c2)Br
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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 C20H19BrN2O4S2 MW 495.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O4S2/c1-2-9-22-14-8-7-12(21)11-13(14)16(18(22)26)17-19(27)23(20(28)29-17)10-5-3-4-6-15(24)25/h2,7-8,11H,1,3-6,9-10H2,(H,24,25)/b17-16-InChIKey
MBZMMIOEBTUIJD-MSUUIHNZSA-NSynonyms
(Z)6(5(1allyl5bromo2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)hexanoicacid
6((5Z)5(5bromo2oxo1(prop2en1yl)12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5(5BROMO2OXO1PROP2ENYLINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
C=CCN1C(=O)C(=C2SC(=S)N(C2=O)CCCCCC(=O)O)c2c1ccc(c2)Br
C=CCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)C1=O
InChI=1SC20H19BrN2O4S2c12922148712(21)1113(14)16(18(22)26)1719(27)23(20(28)2917)10534615(24)25h27811H136910H2(H2425)b1716
MFCD02997702
ZINC000001835148
ZINC1835148
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