2-(3,5-dimethylphenyl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethylphenyl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,5-dimethylphenyl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(3,5-dimethylphenyl)thio]-1-[4-(2-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethylphenyl)sulfanyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3,5-dimethylphenyl)thio]-1-[4-(2-methoxyphenyl)piperazino]ethanone Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C21H26N2O2S/c1-16-12-17(2)14-18(13-16)26-15-21(24)23-10-8-22(9-11-23)19-6-4-5-7-20(19)25-3/h4-7,12-14H,8-11,15H2,1-3H3