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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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