4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[4-(4-chlorophenyl)-1-phthalazinyl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[[4-(4-chlorophenyl)phthalazin-1-yl]amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C25H20ClN5O MolecularWeight: 441.9122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H20ClN5O/c1-16-22(25(32)31(30(16)2)19-8-4-3-5-9-19)27-24-21-11-7-6-10-20(21)23(28-29-24)17-12-14-18(26)15-13-17/h3-15H,1-2H3,(H,27,29)