N-ethoxy-2-(3-methylsulfanylpiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethanamine

Systemtic Name: N-ethoxy-2-(3-methylsulfanylpiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethanamine Openeye Name: 2-(4-benzylphenyl)-N-ethoxy-2-(3-methylsulfanylpiperazin-1-yl)ethanamine CAS Name: N-ethoxy-2-[3-(methylthio)-1-piperazinyl]-2-[4-(phenylmethyl)phenyl]ethanamine IUPAC Name: 2-(4-benzylphenyl)-N-ethoxy-2-(3-methylsulfanylpiperazin-1-yl)ethanamine Traditional Name: [2-(4-benzylphenyl)-2-[3-(methylthio)piperazino]ethyl]-ethoxy-amine Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

CCONCC(C1=CC=C(C=C1)CC2=CC=CC=C2)N3CCNC(C3)SC

Isomeric SMILES

CCONCC(C1=CC=C(C=C1)CC2=CC=CC=C2)N3CCNC(C3)SC

InChI

InChI=1S/C22H31N3OS/c1-3-26-24-16-21(25-14-13-23-22(17-25)27-2)20-11-9-19(10-12-20)15-18-7-5-4-6-8-18/h4-12,21-24H,3,13-17H2,1-2H3