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

Systemtic Name: 4-chloranyl-2-phenyl-5-[4-[(2-phenyl-1,2,3-triazol-4-yl)carbonyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-2-phenyl-5-[4-(2-phenyltriazole-4-carbonyl)piperazin-1-yl]pyridazin-3-one CAS Name: 4-chloro-5-[4-[oxo-(2-phenyl-4-triazolyl)methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-2-phenyl-5-[4-(2-phenyltriazole-4-carbonyl)piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-2-phenyl-5-[4-(2-phenyltriazole-4-carbonyl)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=NN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl)C(=O)C4=NN(N=C4)C5=CC=CC=C5

InChI

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