3-(3-imidazol-1-ylpropyl)-1H-benzimidazole-2-thione

Systemtic Name: 3-(3-imidazol-1-ylpropyl)-1H-benzimidazole-2-thione Openeye Name: 3-(3-imidazol-1-ylpropyl)-1H-benzimidazole-2-thione CAS Name: 3-[3-(1-imidazolyl)propyl]-1H-benzimidazole-2-thione IUPAC Name: 3-(3-imidazol-1-ylpropyl)-1H-benzimidazole-2-thione Traditional Name: 3-(3-imidazol-1-ylpropyl)-1H-benzimidazole-2-thione Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=S)N2CCCN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=S)N2CCCN3C=CN=C3

InChI

InChI=1S/C13H14N4S/c18-13-15-11-4-1-2-5-12(11)17(13)8-3-7-16-9-6-14-10-16/h1-2,4-6,9-10H,3,7-8H2,(H,15,18)