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

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-[4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[oxo-[4-(1,2,4-triazol-1-yl)phenyl]methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-[4-(1,2,4-triazol-1-yl)benzoyl]piperazino]pyridazin-3-one Formula: C23H20ClN7O2 MolecularWeight: 461.9036

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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=CC=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=CC=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C23H20ClN7O2/c24-21-20(14-26-31(23(21)33)19-4-2-1-3-5-19)28-10-12-29(13-11-28)22(32)17-6-8-18(9-7-17)30-16-25-15-27-30/h1-9,14-16H,10-13H2