Vitas-M small molecule compound

ethyl {[3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-1-yl]sulfanyl}acetate

Catalog ID
STK053008
SMILES CCOC(=O)CSC1N(CCc2ccccc2)C(=O)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 C20H21NO3S MW 355.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO3S/c1-2-24-18(22)14-25-20-17-11-7-6-10-16(17)19(23)21(20)13-12-15-8-4-3-5-9-15/h3-11,20H,2,12-14H2,1H3
InChIKey
BGVKCVQXFSHIDI-UHFFFAOYSA-N
Synonyms

CCOC(=O)CSC1C2=CC=CC=C2C(=O)N1CCC3=CC=CC=C3
CCOC(=O)CSC1N(CCc2ccccc2)C(=O)c2c1cccc2
ETHYL((3OXO2(2PHENYLETHYL)23DIHYDRO1HISOINDOL1YL)SULFANYL)ACETATE
ethyl2((3oxo2(2phenylethyl)1Hisoindol1yl)sulfanyl)acetate
InChI=1SC20H21NO3Sc122418(22)1425201711761016(17)19(23)21(20)1312158435915h31120H21214H21H3
MFCD11851028
STK053008
ZINC000009434862
ZINC000009434863

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.