3,5-bis[(4-methylphenyl)sulfanyl]-1-[[4-(3-phenylmethoxypropoxy)phenyl]methyl]piperidine

Systemtic Name: 3,5-bis[(4-methylphenyl)sulfanyl]-1-[[4-(3-phenylmethoxypropoxy)phenyl]methyl]piperidine Openeye Name: 1-[[4-(3-benzyloxypropoxy)phenyl]methyl]-3,5-bis(p-tolylsulfanyl)piperidine CAS Name: 3,5-bis[(4-methylphenyl)thio]-1-[[4-(3-phenylmethoxypropoxy)phenyl]methyl]piperidine IUPAC Name: 3,5-bis[(4-methylphenyl)sulfanyl]-1-[[4-(3-phenylmethoxypropoxy)phenyl]methyl]piperidine Traditional Name: 1-[4-(3-benzoxypropoxy)benzyl]-3,5-bis(p-tolylthio)piperidine Formula: C36H41NO2S2 MolecularWeight: 583.84624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CC(CN(C2)CC3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)SC5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2CC(CN(C2)CC3=CC=C(C=C3)OCCCOCC4=CC=CC=C4)SC5=CC=C(C=C5)C

InChI

InChI=1S/C36H41NO2S2/c1-28-9-17-33(18-10-28)40-35-23-36(41-34-19-11-29(2)12-20-34)26-37(25-35)24-30-13-15-32(16-14-30)39-22-6-21-38-27-31-7-4-3-5-8-31/h3-5,7-20,35-36H,6,21-27H2,1-2H3