(3S,5S)-5-[[(4-methoxyphenyl)methyl-(naphthalen-1-ylmethyl)amino]methyl]pyrrolidine-3-thiol

Systemtic Name: (3S,5S)-5-[[(4-methoxyphenyl)methyl-(naphthalen-1-ylmethyl)amino]methyl]pyrrolidine-3-thiol Openeye Name: (3S,5S)-5-[[(4-methoxyphenyl)methyl-(1-naphthylmethyl)amino]methyl]pyrrolidine-3-thiol CAS Name: (3S,5S)-5-[[(4-methoxyphenyl)methyl-(1-naphthalenylmethyl)amino]methyl]-3-pyrrolidinethiol IUPAC Name: (3S,5S)-5-[[(4-methoxyphenyl)methyl-(naphthalen-1-ylmethyl)amino]methyl]pyrrolidine-3-thiol Traditional Name: (3S,5S)-5-[[1-naphthylmethyl(p-anisyl)amino]methyl]pyrrolidine-3-thiol Formula: C24H28N2OS MolecularWeight: 392.55692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2CC(CN2)S)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)CN(C[C@@H]2C[C@@H](CN2)S)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H28N2OS/c1-27-22-11-9-18(10-12-22)15-26(17-21-13-23(28)14-25-21)16-20-7-4-6-19-5-2-3-8-24(19)20/h2-12,21,23,25,28H,13-17H2,1H3/t21-,23-/m0/s1