Vitas-M small molecule compound

(3Z)-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
STK821698
SMILES CCCCN1C(=O)/C(=C/2\SC(=S)N(C2=O)CC2CCCO2)/c2c1cccc2

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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 C20H22N2O3S2 MW 402.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S2/c1-2-3-10-21-15-9-5-4-8-14(15)16(18(21)23)17-19(24)22(20(26)27-17)12-13-7-6-11-25-13/h4-5,8-9,13H,2-3,6-7,10-12H2,1H3/b17-16-
InChIKey
JPRPKAWEGMOTJY-MSUUIHNZSA-N
Synonyms

(3Z)1butyl3(4oxo3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(1BUTYL2OXOINDOL3YLIDENE)3(OXOLAN2YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CCCCN1C(=O)C(=C2SC(=S)N(C2=O)CC2CCCO2)c2c1cccc2
CCCCN1C2=CC=CC=C2C(=C3C(=O)N(C(=S)S3)CC4CCCO4)C1=O
InChI=1SC20H22N2O3S2c123102115954814(15)16(18(21)23)1719(24)22(20(26)2717)121376112513h458913H23671012H21H3b1716
MFCD03418359
ZINC000006042633
ZINC000006042634

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Available files

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