1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone CAS Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-2-[(2,5-dimethylphenyl)thio]ethanone IUPAC Name: 1-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanylethanone Traditional Name: 1-[4-(2,5-dimethoxybenzyl)piperazino]-2-[(2,5-dimethylphenyl)thio]ethanone Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)N2CCN(CC2)CC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C23H30N2O3S/c1-17-5-6-18(2)22(13-17)29-16-23(26)25-11-9-24(10-12-25)15-19-14-20(27-3)7-8-21(19)28-4/h5-8,13-14H,9-12,15-16H2,1-4H3