1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-methylsulfanylphenyl)piperazine

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-methylsulfanylphenyl)piperazine Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-methylsulfanylphenyl)piperazine CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-[2-(methylthio)phenyl]piperazine IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-methylsulfanylphenyl)piperazine Traditional Name: 1-homoveratryl-4-[2-(methylthio)phenyl]piperazine Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2CCN(CC2)C3=CC=CC=C3SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2CCN(CC2)C3=CC=CC=C3SC)OC

InChI

InChI=1S/C21H28N2O2S/c1-24-19-9-8-17(16-20(19)25-2)10-11-22-12-14-23(15-13-22)18-6-4-5-7-21(18)26-3/h4-9,16H,10-15H2,1-3H3