Vitas-M small molecule compound
(3Z)-5-bromo-1-butyl-3-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK814454
SMILES CCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CC2CCCO2)/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 C20H21BrN2O3S2 MW 481.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O3S2/c1-2-3-8-22-15-7-6-12(21)10-14(15)16(18(22)24)17-19(25)23(20(27)28-17)11-13-5-4-9-26-13/h6-7,10,13H,2-5,8-9,11H2,1H3/b17-16-InChIKey
DVXNOHDNNSIFOT-MSUUIHNZSA-NSynonyms
618075-44-8(3Z)5bromo1butyl3(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(5BROMO1BUTYL2OXOINDOL3YLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5(5BROMO1BUTYL2OXOINDOLIN3YLIDENE)3((TETRAHYDROFURAN2YL)METHYL)2THIOXOTHIAZOLIDIN4ONE
618075448
CCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CC4CCCO4)C1=O
InChI=1SC20H21BrN2O3S2c123822157612(21)1014(15)16(18(22)24)1719(25)23(20(27)2817)11135492613h671013H258911H21H3b1716
MFCD03535156
ZINC000016731375
ZINC000016731378
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