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

Systemtic Name: 2-(3-methylsulfanylpiperazin-1-yl)-N-(phenylmethyl)-2-[4-(phenylmethyl)phenyl]ethanamine Openeye Name: N-benzyl-2-(4-benzylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethanamine CAS Name: 2-[3-(methylthio)-1-piperazinyl]-N-(phenylmethyl)-2-[4-(phenylmethyl)phenyl]ethanamine IUPAC Name: N-benzyl-2-(4-benzylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethanamine Traditional Name: benzyl-[2-(4-benzylphenyl)-2-[3-(methylthio)piperazino]ethyl]amine Formula: C27H33N3S MolecularWeight: 431.63602

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CN(CCN1)C(CNCC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1CN(CCN1)C(CNCC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H33N3S/c1-31-27-21-30(17-16-29-27)26(20-28-19-24-10-6-3-7-11-24)25-14-12-23(13-15-25)18-22-8-4-2-5-9-22/h2-15,26-29H,16-21H2,1H3