Vitas-M small molecule compound

ethyl 3-[(4-phenylpiperazin-1-yl)sulfonyl]-1-benzothiophene-2-carboxylate

Catalog ID
STL095875
SMILES CCOC(=O)c1sc2c(c1S(=O)(=O)N1CCN(CC1)c1ccccc1)cccc2

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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 C21H22N2O4S2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S2/c1-2-27-21(24)19-20(17-10-6-7-11-18(17)28-19)29(25,26)23-14-12-22(13-15-23)16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3
InChIKey
UNXZITKKVLWOLU-UHFFFAOYSA-N
Synonyms
895266-73-6
895266736
CCOC(=O)C1=C(C2=CC=CC=C2S1)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4
ethyl3((4phenylpiperazin1yl)sulfonyl)1benzothiophene2carboxylate
ETHYL3((4PHENYLPIPERAZIN1YL)SULFONYL)BENZO(B)THIOPHENE2CARBOXYLATE
ethyl3(4phenylpiperazin1yl)sulfonyl1benzothiophene2carboxylate
InChI=1SC21H22N2O4S2c122721(24)1920(1710671118(17)2819)29(2526)23141222(131523)168435916h311H21215H21H3
MFCD07656274
ZINC000008583780
ZINC08583780
ZINC8583780

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Available files

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