1-[4-(4-chlorophenyl)sulfanylbutyl]benzimidazole; ethanedioic acid

Systemtic Name: 1-[4-(4-chlorophenyl)sulfanylbutyl]benzimidazole; ethanedioic acid Openeye Name: 1-[4-(4-chlorophenyl)sulfanylbutyl]benzimidazole; oxalic acid CAS Name: 1-[4-[(4-chlorophenyl)thio]butyl]benzimidazole; oxalic acid IUPAC Name: 1-[4-(4-chlorophenyl)sulfanylbutyl]benzimidazole; oxalic acid Traditional Name: 1-[4-[(4-chlorophenyl)thio]butyl]benzimidazole; oxalic acid Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CCCCSC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CCCCSC3=CC=C(C=C3)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H17ClN2S.C2H2O4/c18-14-7-9-15(10-8-14)21-12-4-3-11-20-13-19-16-5-1-2-6-17(16)20;3-1(4)2(5)6/h1-2,5-10,13H,3-4,11-12H2;(H,3,4)(H,5,6)