5-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[4-(benzothiophene-2-carbonyl)piperazin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[1-benzothiophen-2-yl(oxo)methyl]-1-piperazinyl]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[4-(benzothiophene-2-carbonyl)piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C23H19ClN4O2S MolecularWeight: 450.94056

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C23H19ClN4O2S/c24-21-18(15-25-28(23(21)30)17-7-2-1-3-8-17)26-10-12-27(13-11-26)22(29)20-14-16-6-4-5-9-19(16)31-20/h1-9,14-15H,10-13H2