(4-methylphenyl)-[2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]carbonylphenyl]methanone

Systemtic Name: (4-methylphenyl)-[2-[4-(6-phenylpyridazin-3-yl)piperazin-1-yl]carbonylphenyl]methanone Openeye Name: [2-[4-(6-phenylpyridazin-3-yl)piperazine-1-carbonyl]phenyl]-(p-tolyl)methanone CAS Name: (4-methylphenyl)-[2-[oxo-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: (4-methylphenyl)-[2-[4-(6-phenylpyridazin-3-yl)piperazine-1-carbonyl]phenyl]methanone Traditional Name: [2-[4-(6-phenylpyridazin-3-yl)piperazine-1-carbonyl]phenyl]-(p-tolyl)methanone Formula: C29H26N4O2 MolecularWeight: 462.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C4=NN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCN(CC3)C4=NN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N4O2/c1-21-11-13-23(14-12-21)28(34)24-9-5-6-10-25(24)29(35)33-19-17-32(18-20-33)27-16-15-26(30-31-27)22-7-3-2-4-8-22/h2-16H,17-20H2,1H3