Vitas-M small molecule compound

(3Z)-1-benzyl-5-bromo-3-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one

Catalog ID
STK814923
SMILES CCC(N1C(=S)S/C(=C\2/c3cc(Br)ccc3N(C2=O)Cc2ccccc2)/C1=O)C

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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 C22H19BrN2O2S2 MW 487.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O2S2/c1-3-13(2)25-21(27)19(29-22(25)28)18-16-11-15(23)9-10-17(16)24(20(18)26)12-14-7-5-4-6-8-14/h4-11,13H,3,12H2,1-2H3/b19-18-
InChIKey
RRLBWFUHFHMWBN-HNENSFHCSA-N
Synonyms

(3Z)1benzyl5bromo3(3(butan2yl)4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(1BENZYL5BROMO2OXOINDOL3YLIDENE)3BUTAN2YL2SULFANYLIDENE13THIAZOLIDIN4ONE
CCC(C)N1C(=O)C(=C2C3=C(C=CC(=C3)Br)N(C2=O)CC4=CC=CC=C4)SC1=S
CCC(N1C(=S)SC(=C2c3cc(Br)ccc3N(C2=O)Cc2ccccc2)C1=O)C
InChI=1SC22H19BrN2O2S2c1313(2)2521(27)19(2922(25)28)18161115(23)91017(16)24(20(18)26)12147546814h41113H312H212H3b1918
MFCD03535385
ZINC000016731861
ZINC000016731864

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Available files

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