5-imidazol-1-yl-3-pentan-3-yl-1H-benzimidazole-2-thione

Systemtic Name: 5-imidazol-1-yl-3-pentan-3-yl-1H-benzimidazole-2-thione Openeye Name: 3-(1-ethylpropyl)-5-imidazol-1-yl-1H-benzimidazole-2-thione CAS Name: 5-(1-imidazolyl)-3-pentan-3-yl-1H-benzimidazole-2-thione IUPAC Name: 5-imidazol-1-yl-3-pentan-3-yl-1H-benzimidazole-2-thione Traditional Name: 3-(1-ethylpropyl)-5-imidazol-1-yl-1H-benzimidazole-2-thione Formula: C15H18N4S MolecularWeight: 286.39522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=C(C=CC(=C2)N3C=CN=C3)NC1=S

Isomeric SMILES

CCC(CC)N1C2=C(C=CC(=C2)N3C=CN=C3)NC1=S

InChI

InChI=1S/C15H18N4S/c1-3-11(4-2)19-14-9-12(18-8-7-16-10-18)5-6-13(14)17-15(19)20/h5-11H,3-4H2,1-2H3,(H,17,20)