5-[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[4-[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-1-piperazinyl]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazin-1-yl]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[4-[4-(1,3-benzothiazol-2-yl)butanoyl]piperazino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C25H24ClN5O2S MolecularWeight: 494.00836

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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)CCCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)CCCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H24ClN5O2S/c26-24-20(17-27-31(25(24)33)18-7-2-1-3-8-18)29-13-15-30(16-14-29)23(32)12-6-11-22-28-19-9-4-5-10-21(19)34-22/h1-5,7-10,17H,6,11-16H2