1-[2-[(4-chlorophenyl)methylsulfanyl]-2-naphthalen-2-yl-ethyl]imidazole nitrate

Systemtic Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-2-naphthalen-2-yl-ethyl]imidazole nitrate Openeye Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-2-(2-naphthyl)ethyl]imidazole nitrate CAS Name: 1-[2-[(4-chlorophenyl)methylthio]-2-(2-naphthalenyl)ethyl]imidazole nitrate IUPAC Name: 1-[2-[(4-chlorophenyl)methylsulfanyl]-2-naphthalen-2-ylethyl]imidazole nitrate Traditional Name: 1-[2-[(4-chlorobenzyl)thio]-2-(2-naphthyl)ethyl]imidazole nitrate Formula: C22H19ClN3O3S- MolecularWeight: 440.92256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(CN3C=CN=C3)SCC4=CC=C(C=C4)Cl.[N+](=O)([O-])[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(CN3C=CN=C3)SCC4=CC=C(C=C4)Cl.[N+](=O)([O-])[O-]

InChI

InChI=1S/C22H19ClN2S.NO3/c23-21-9-5-17(6-10-21)15-26-22(14-25-12-11-24-16-25)20-8-7-18-3-1-2-4-19(18)13-20;2-1(3)4/h1-13,16,22H,14-15H2;/q;-1