Vitas-M small molecule compound

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

Catalog ID
STK814929
SMILES Brc1ccc2c(c1)/C(=C\1/SC(=S)N(C1=O)CC1CCCO1)/C(=O)N2Cc1ccccc1

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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 C23H19BrN2O3S2 MW 515.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O3S2/c24-15-8-9-18-17(11-15)19(21(27)25(18)12-14-5-2-1-3-6-14)20-22(28)26(23(30)31-20)13-16-7-4-10-29-16/h1-3,5-6,8-9,11,16H,4,7,10,12-13H2/b20-19-
InChIKey
AWBLPFIMSDNFBV-VXPUYCOJSA-N
Synonyms

(3Z)1benzyl5bromo3(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(1BENZYL5BROMO2OXOINDOL3YLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
C1CC(OC1)CN2C(=O)C(=C3C4=C(C=CC(=C4)Br)N(C3=O)CC5=CC=CC=C5)SC2=S
InChI=1SC23H19BrN2O3S2c2415891817(1115)19(21(27)25(18)12145213614)2022(28)26(23(30)3120)131674102916h1356891116H47101213H2b2019
MFCD03535153
ZINC000016731873
ZINC000016731876

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Available files

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