3-[5-(11-imidazol-1-ylundecyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[5-(11-imidazol-1-ylundecyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[5-(11-imidazol-1-ylundecyl)-2-thienyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[5-[11-(1-imidazolyl)undecyl]-2-thiophenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[5-(11-imidazol-1-ylundecyl)thiophen-2-yl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[5-(11-imidazol-1-ylundecyl)-2-thienyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC=C(S2)CCCCCCCCCCCN3C=CN=C3

Isomeric SMILES

C1CC(=O)NN=C1C2=CC=C(S2)CCCCCCCCCCCN3C=CN=C3

InChI

InChI=1S/C22H32N4OS/c27-22-14-12-20(24-25-22)21-13-11-19(28-21)10-8-6-4-2-1-3-5-7-9-16-26-17-15-23-18-26/h11,13,15,17-18H,1-10,12,14,16H2,(H,25,27)