N-methylsulfanyl-2-[3-(phenylmethyl)piperazin-1-yl]-2-(4-propylphenyl)ethanamine

Systemtic Name: N-methylsulfanyl-2-[3-(phenylmethyl)piperazin-1-yl]-2-(4-propylphenyl)ethanamine Openeye Name: 2-(3-benzylpiperazin-1-yl)-N-methylsulfanyl-2-(4-propylphenyl)ethanamine CAS Name: N-[2-[3-(phenylmethyl)-1-piperazinyl]-2-(4-propylphenyl)ethyl]methanesulfenamide IUPAC Name: 2-(3-benzylpiperazin-1-yl)-N-methylsulfanyl-2-(4-propylphenyl)ethanamine Traditional Name: [2-(3-benzylpiperazino)-2-(4-propylphenyl)ethyl]-(methylthio)amine Formula: C23H33N3S MolecularWeight: 383.59322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)C(CNSC)N2CCNC(C2)CC3=CC=CC=C3

InChI

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