3-[5-(9-imidazol-1-ylnonyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[5-(9-imidazol-1-ylnonyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[5-(9-imidazol-1-ylnonyl)-2-thienyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[5-[9-(1-imidazolyl)nonyl]-2-thiophenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[5-(9-imidazol-1-ylnonyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[5-(9-imidazol-1-ylnonyl)-2-thienyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C20H28N4OS MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC=C(S2)CCCCCCCCCN3C=CN=C3

Isomeric SMILES

C1CC(=O)NN=C1C2=CC=C(S2)CCCCCCCCCN3C=CN=C3

InChI

InChI=1S/C20H28N4OS/c25-20-12-10-18(22-23-20)19-11-9-17(26-19)8-6-4-2-1-3-5-7-14-24-15-13-21-16-24/h9,11,13,15-16H,1-8,10,12,14H2,(H,23,25)