6-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one

Systemtic Name: 6-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one Openeye Name: 6-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-2-propyl-pyridazin-3-one CAS Name: 6-[[4-[[5-(3-fluorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-oxomethyl]-2-propyl-3-pyridazinone IUPAC Name: 6-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazine-1-carbonyl]-2-propylpyridazin-3-one Traditional Name: 6-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-2-propyl-pyridazin-3-one Formula: C23H25FN4O2S MolecularWeight: 440.533603

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)CC3=CC=C(S3)C4=CC(=CC=C4)F

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)CC3=CC=C(S3)C4=CC(=CC=C4)F

InChI

InChI=1S/C23H25FN4O2S/c1-2-10-28-22(29)9-7-20(25-28)23(30)27-13-11-26(12-14-27)16-19-6-8-21(31-19)17-4-3-5-18(24)15-17/h3-9,15H,2,10-14,16H2,1H3