1-(4-methylsulfonylpiperazin-1-yl)-2-[phenethyl(thiophen-2-ylmethyl)amino]ethanone

Systemtic Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[phenethyl(thiophen-2-ylmethyl)amino]ethanone Openeye Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[phenethyl(2-thienylmethyl)amino]ethanone CAS Name: 1-(4-methylsulfonyl-1-piperazinyl)-2-[phenethyl(thiophen-2-ylmethyl)amino]ethanone IUPAC Name: 1-(4-methylsulfonylpiperazin-1-yl)-2-[phenethyl(thiophen-2-ylmethyl)amino]ethanone Traditional Name: 1-(4-mesylpiperazino)-2-[phenethyl(2-thenyl)amino]ethanone Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CN(CCC2=CC=CC=C2)CC3=CC=CS3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CN(CCC2=CC=CC=C2)CC3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-28(25,26)23-13-11-22(12-14-23)20(24)17-21(16-19-8-5-15-27-19)10-9-18-6-3-2-4-7-18/h2-8,15H,9-14,16-17H2,1H3