Vitas-M small molecule compound

ethyl 5-{3,4-bis[(phenylcarbonyl)amino]tetrahydrothiophen-2-yl}pentanoate

Catalog ID
STK693547
SMILES CCOC(=O)CCCCC1SCC(C1NC(=O)c1ccccc1)NC(=O)c1ccccc1

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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 C25H30N2O4S MW 454.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4S/c1-2-31-22(28)16-10-9-15-21-23(27-25(30)19-13-7-4-8-14-19)20(17-32-21)26-24(29)18-11-5-3-6-12-18/h3-8,11-14,20-21,23H,2,9-10,15-17H2,1H3,(H,26,29)(H,27,30)
InChIKey
HFZSWRHQZIOJPL-UHFFFAOYSA-N
Synonyms

5(34BISBENZOYLAMINOTETRAHYDROTHIOPHEN2YL)PENTANOICACIDETHYLESTER
CCOC(=O)CCCCC1C(C(CS1)NC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3
ethyl5(34bis((phenylcarbonyl)amino)tetrahydrothiophen2yl)pentanoate
ETHYL5(34DIBENZAMIDOTHIOLAN2YL)PENTANOATE
InChI=1SC25H30N2O4Sc123122(28)16109152123(2725(30)19137481419)20(173221)2624(29)18115361218h381114202123H29101517H21H3(H2629)(H2730)
MFCD02029183
ZINC000006546096
ZINC000239309178

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Available files

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