Vitas-M small molecule compound

methyl 3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}thiophene-2-carboxylate

Catalog ID
STL095525
SMILES COC(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C

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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 C18H22N2O4S2 MW 394.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O4S2/c1-13-5-4-6-15(14(13)2)19-8-10-20(11-9-19)26(22,23)16-7-12-25-17(16)18(21)24-3/h4-7,12H,8-11H2,1-3H3
InChIKey
ZONISTFUZMAWBM-UHFFFAOYSA-N
Synonyms
895262-99-4
895262994
CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC)C
InChI=1SC18H22N2O4S2c11354615(14(13)2)1981020(11919)26(2223)167122517(16)18(21)243h4712H811H213H3
methyl3((4(23dimethylphenyl)piperazin1yl)sulfonyl)thiophene2carboxylate
METHYL3(4(23DIMETHYLPHENYL)PIPERAZIN1YL)SULFONYLTHIOPHENE2CARBOXYLATE
MFCD07656271
ZINC000004372263
ZINC04372263
ZINC4372263

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Available files

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