1-(2,5-dimethylthiophen-3-yl)-2-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 1-(2,5-dimethylthiophen-3-yl)-2-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 1-(2,5-dimethyl-3-thienyl)-2-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 1-(2,5-dimethyl-3-thiophenyl)-2-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 1-(2,5-dimethylthiophen-3-yl)-2-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 1-(2,5-dimethyl-3-thienyl)-2-(4-mesylpiperazino)ethanone Formula: C13H20N2O3S2 MolecularWeight: 316.4395

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C13H20N2O3S2/c1-10-8-12(11(2)19-10)13(16)9-14-4-6-15(7-5-14)20(3,17)18/h8H,4-7,9H2,1-3H3