Vitas-M small molecule compound
2-{(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}ethanesulfonic acid
Catalog ID
STK702300
SMILES C=CCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CCS(=O)(=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 C16H13BrN2O5S3 MW 489.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN2O5S3/c1-2-5-18-11-4-3-9(17)8-10(11)12(14(18)20)13-15(21)19(16(25)26-13)6-7-27(22,23)24/h2-4,8H,1,5-7H2,(H,22,23,24)/b13-12-InChIKey
LRFRWBBCFKLHCO-SEYXRHQNSA-NSynonyms
(Z)2(5(1allyl5bromo2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)ethanesulfonicacid
2((5Z)5(5bromo2oxo1(prop2en1yl)12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)ethanesulfonicacid
2((5Z)5(5BROMO2OXO1PROP2ENYLINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ETHANESULFONICACID
C=CCN1C(=O)C(=C2SC(=S)N(C2=O)CCS(=O)(=O)O)c2c1ccc(c2)Br
C=CCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O)C1=O
InChI=1SC16H13BrN2O5S3c1251811439(17)810(11)12(14(18)20)1315(21)19(16(25)2613)6727(2223)24h248H157H2(H222324)b1312
MFCD02992464
ZINC000002292671
ZINC2292671
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