1-[2-naphthalen-2-yl-2,2-bis(phenylmethylsulfanyl)ethyl]imidazole hydrochloride

Systemtic Name: 1-[2-naphthalen-2-yl-2,2-bis(phenylmethylsulfanyl)ethyl]imidazole hydrochloride Openeye Name: 1-[2,2-bis(benzylsulfanyl)-2-(2-naphthyl)ethyl]imidazole hydrochloride CAS Name: 1-[2-(2-naphthalenyl)-2,2-bis(phenylmethylthio)ethyl]imidazole hydrochloride IUPAC Name: 1-[2,2-bis(benzylsulfanyl)-2-naphthalen-2-ylethyl]imidazole hydrochloride Traditional Name: 1-[2,2-bis(benzylthio)-2-(2-naphthyl)ethyl]imidazole hydrochloride Formula: C29H27ClN2S2 MolecularWeight: 503.12108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(CN2C=CN=C2)(C3=CC4=CC=CC=C4C=C3)SCC5=CC=CC=C5.Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC(CN2C=CN=C2)(C3=CC4=CC=CC=C4C=C3)SCC5=CC=CC=C5.Cl

InChI

InChI=1S/C29H26N2S2.ClH/c1-3-9-24(10-4-1)20-32-29(22-31-18-17-30-23-31,33-21-25-11-5-2-6-12-25)28-16-15-26-13-7-8-14-27(26)19-28;/h1-19,23H,20-22H2;1H