1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]imidazole; ethanedioic acid

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]imidazole; ethanedioic acid Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]imidazole; oxalic acid CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]imidazole; oxalic acid IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]imidazole; oxalic acid Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]imidazole; oxalic acid Formula: C15H17ClN2O5S MolecularWeight: 372.82388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCOCCN2C=CN=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC(=CC=C1SCCOCCN2C=CN=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H15ClN2OS.C2H2O4/c14-12-1-3-13(4-2-12)18-10-9-17-8-7-16-6-5-15-11-16;3-1(4)2(5)6/h1-6,11H,7-10H2;(H,3,4)(H,5,6)