1-[2-[(4-butylsulfanylphenyl)-(4-methylphenyl)methyl]sulfanylethyl]piperidine

Systemtic Name: 1-[2-[(4-butylsulfanylphenyl)-(4-methylphenyl)methyl]sulfanylethyl]piperidine Openeye Name: 1-[2-[(4-butylsulfanylphenyl)-(p-tolyl)methyl]sulfanylethyl]piperidine CAS Name: 1-[2-[[[4-(butylthio)phenyl]-(4-methylphenyl)methyl]thio]ethyl]piperidine IUPAC Name: 1-[2-[(4-butylsulfanylphenyl)-(4-methylphenyl)methyl]sulfanylethyl]piperidine Traditional Name: 1-[2-[[[4-(butylthio)phenyl]-(p-tolyl)methyl]thio]ethyl]piperidine Formula: C25H35NS2 MolecularWeight: 413.6821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)SCCN3CCCCC3

Isomeric SMILES

CCCCSC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)SCCN3CCCCC3

InChI

InChI=1S/C25H35NS2/c1-3-4-19-27-24-14-12-23(13-15-24)25(22-10-8-21(2)9-11-22)28-20-18-26-16-6-5-7-17-26/h8-15,25H,3-7,16-20H2,1-2H3