Vitas-M small molecule compound

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

Catalog ID
STK814145
SMILES CCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)Cc2ccc(cc2)OC)/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 C23H21BrN2O3S2 MW 517.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN2O3S2/c1-3-4-11-25-18-10-7-15(24)12-17(18)19(21(25)27)20-22(28)26(23(30)31-20)13-14-5-8-16(29-2)9-6-14/h5-10,12H,3-4,11,13H2,1-2H3/b20-19-
InChIKey
VPSQTGQBUWTVFW-VXPUYCOJSA-N
Synonyms
618077-65-9
(3Z)5bromo1butyl3(3(4methoxybenzyl)4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(5BROMO1BUTYL2OXOINDOL3YLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
5(5BROMO1BUTYL2OXOINDOLIN3YLIDENE)3(4METHOXYBENZYL)2THIOXOTHIAZOLIDIN4ONE
618077659
CCCCN1C(=O)C(=C2SC(=S)N(C2=O)Cc2ccc(cc2)OC)c2c1ccc(c2)Br
CCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC)C1=O
InChI=1SC23H21BrN2O3S2c13411251810715(24)1217(18)19(21(25)27)2022(28)26(23(30)3120)13145816(292)9614h51012H341113H212H3b2019
MFCD03535460
ZINC000016730787
ZINC16730787

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Available files

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