6-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one

Systemtic Name: 6-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one Openeye Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-propyl-pyridazin-3-one CAS Name: 6-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-2-propyl-3-pyridazinone IUPAC Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-propylpyridazin-3-one Traditional Name: 6-(4-besylpiperazine-1-carbonyl)-2-propyl-pyridazin-3-one Formula: C18H22N4O4S MolecularWeight: 390.45668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O4S/c1-2-10-22-17(23)9-8-16(19-22)18(24)20-11-13-21(14-12-20)27(25,26)15-6-4-3-5-7-15/h3-9H,2,10-14H2,1H3