1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-[methyl-(phenylmethyl)amino]ethanone

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-[methyl-(phenylmethyl)amino]ethanone Openeye Name: 2-[benzyl(methyl)amino]-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-[methyl-(phenylmethyl)amino]ethanone IUPAC Name: 2-[benzyl(methyl)amino]-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-[benzyl(methyl)amino]-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]ethanone Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O5S/c1-23(16-18-7-5-4-6-8-18)17-22(26)24-11-13-25(14-12-24)31(27,28)19-9-10-20(29-2)21(15-19)30-3/h4-10,15H,11-14,16-17H2,1-3H3