2-[(3-methoxyphenyl)methyl-methyl-amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(3-methoxyphenyl)methyl-methyl-amino]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(3-methoxyphenyl)methyl-methyl-amino]ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[(3-methoxyphenyl)methyl-methylamino]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(3-methoxyphenyl)methyl-methylamino]ethanone Traditional Name: 1-(4-besylpiperazino)-2-[m-anisyl(methyl)amino]ethanone Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)OC)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC(=CC=C1)OC)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O4S/c1-22(16-18-7-6-8-19(15-18)28-2)17-21(25)23-11-13-24(14-12-23)29(26,27)20-9-4-3-5-10-20/h3-10,15H,11-14,16-17H2,1-2H3