2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)-2-(4-propylphenyl)ethanamine

Systemtic Name: 2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)-2-(4-propylphenyl)ethanamine Openeye Name: N-benzyl-2-(3-methylsulfanylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine CAS Name: 2-[3-(methylthio)-1-piperazinyl]-N-(phenylmethyl)-2-(4-propylphenyl)ethanamine IUPAC Name: N-benzyl-2-(3-methylsulfanylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine Traditional Name: benzyl-[2-[3-(methylthio)piperazino]-2-(4-propylphenyl)ethyl]amine Formula: C23H33N3S MolecularWeight: 383.59322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

Isomeric SMILES

CCCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)SC

InChI

InChI=1S/C23H33N3S/c1-3-7-19-10-12-21(13-11-19)22(26-15-14-25-23(18-26)27-2)17-24-16-20-8-5-4-6-9-20/h4-6,8-13,22-25H,3,7,14-18H2,1-2H3