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

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]benzimidazole; ethanedioic acid Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]benzimidazole; oxalic acid CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]benzimidazole; oxalic acid IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]benzimidazole; oxalic acid Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]benzimidazole; oxalic acid Formula: C19H19ClN2O5S MolecularWeight: 422.88256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCOCCSC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCOCCSC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H17ClN2OS.C2H2O4/c18-14-5-7-15(8-6-14)22-12-11-21-10-9-20-13-19-16-3-1-2-4-17(16)20;3-1(4)2(5)6/h1-8,13H,9-12H2;(H,3,4)(H,5,6)