4-chloranyl-5-[4-(2,5-dimethylfuran-3-yl)carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-(2,5-dimethylfuran-3-yl)carbonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[(2,5-dimethyl-3-furanyl)-oxomethyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-(2,5-dimethylfuran-3-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[4-(2,5-dimethyl-3-furoyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C21H21ClN4O3 MolecularWeight: 412.86944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H21ClN4O3/c1-14-12-17(15(2)29-14)20(27)25-10-8-24(9-11-25)18-13-23-26(21(28)19(18)22)16-6-4-3-5-7-16/h3-7,12-13H,8-11H2,1-2H3