Vitas-M small molecule compound

methyl 3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl}thiophene-2-carboxylate

Catalog ID
STL095523
SMILES COC(=O)c1sccc1S(=O)(=O)N1CCN(CC1)c1cc(C)ccc1C

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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/c1-13-4-5-14(2)15(12-13)19-7-9-20(10-8-19)26(22,23)16-6-11-25-17(16)18(21)24-3/h4-6,11-12H,7-10H2,1-3H3
InChIKey
UAMRWWWSCFTKKY-UHFFFAOYSA-N
Synonyms
895262-86-9
895262869
CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC
InChI=1SC18H22N2O4S2c1134514(2)15(1213)197920(10819)26(2223)166112517(16)18(21)243h461112H710H213H3
methyl3((4(25dimethylphenyl)piperazin1yl)sulfonyl)thiophene2carboxylate
METHYL3(4(25DIMETHYLPHENYL)PIPERAZIN1YL)SULFONYLTHIOPHENE2CARBOXYLATE
MFCD08140531
ZINC000006915101
ZINC06915101
ZINC6915101

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Available files

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