2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-6-imidazol-1-yl-pyridazin-3-one

Systemtic Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-6-imidazol-1-yl-pyridazin-3-one Openeye Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-6-imidazol-1-yl-pyridazin-3-one CAS Name: 2-[4-[4-(2-chlorophenyl)-1-piperazinyl]butyl]-6-(1-imidazolyl)-3-pyridazinone IUPAC Name: 2-[4-[4-(2-chlorophenyl)piperazin-1-yl]butyl]-6-imidazol-1-ylpyridazin-3-one Traditional Name: 2-[4-[4-(2-chlorophenyl)piperazino]butyl]-6-imidazol-1-yl-pyridazin-3-one Formula: C21H25ClN6O MolecularWeight: 412.9158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)N3C=CN=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C=CC(=N2)N3C=CN=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H25ClN6O/c22-18-5-1-2-6-19(18)26-15-13-25(14-16-26)10-3-4-11-28-21(29)8-7-20(24-28)27-12-9-23-17-27/h1-2,5-9,12,17H,3-4,10-11,13-16H2