Vitas-M small molecule compound
6-[(5Z)-5-(5-bromo-1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoic acid
Catalog ID
STK816222
SMILES CCCCN1C(=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 C21H23BrN2O4S2 MW 511.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN2O4S2/c1-2-3-10-23-15-9-8-13(22)12-14(15)17(19(23)27)18-20(28)24(21(29)30-18)11-6-4-5-7-16(25)26/h8-9,12H,2-7,10-11H2,1H3,(H,25,26)/b18-17-InChIKey
CZMADMMCJWDMQI-ZCXUNETKSA-NSynonyms
6((5Z)5(5bromo1butyl2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)hexanoicacid
6((5Z)5(5BROMO1BUTYL2OXOINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)HEXANOICACID
CCCCN1C(=O)C(=C2SC(=S)N(C2=O)CCCCCC(=O)O)c2c1ccc(c2)Br
CCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CCCCCC(=O)O)C1=O
InChI=1SC21H23BrN2O4S2c1231023159813(22)1214(15)17(19(23)27)1820(28)24(21(29)3018)11645716(25)26h8912H271011H21H3(H2526)b1817
MFCD03535227
ZINC000016733279
ZINC16733279
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