Vitas-M small molecule compound
(3Z)-5-bromo-1-hexyl-3-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814913
SMILES CCCCCCN1c2ccc(cc2/C(=C\2/SC(=S)N(C2=O)CC=C)/C1=O)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 C20H21BrN2O2S2 MW 465.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O2S2/c1-3-5-6-7-11-22-15-9-8-13(21)12-14(15)16(18(22)24)17-19(25)23(10-4-2)20(26)27-17/h4,8-9,12H,2-3,5-7,10-11H2,1H3/b17-16-InChIKey
UMZFKSKXMBFSNS-MSUUIHNZSA-NSynonyms
(3Z)5bromo1hexyl3(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(5BROMO1HEXYL2OXOINDOL3YLIDENE)3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CC=C)C1=O
CCCCCCN1c2ccc(cc2C(=C2SC(=S)N(C2=O)CC=C)C1=O)Br
InChI=1SC20H21BrN2O2S2c135671122159813(21)1214(15)16(18(22)24)1719(25)23(1042)20(26)2717h48912H23571011H21H3b1716
MFCD04442399
ZINC000016731836
ZINC16731836
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