4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 2-phenyl-4-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]-2-phenylphthalazin-1-one Traditional Name: 2-phenyl-4-(4-tosylpiperazine-1-carbonyl)phthalazin-1-one Formula: C26H24N4O4S MolecularWeight: 488.55816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H24N4O4S/c1-19-11-13-21(14-12-19)35(33,34)29-17-15-28(16-18-29)26(32)24-22-9-5-6-10-23(22)25(31)30(27-24)20-7-3-2-4-8-20/h2-14H,15-18H2,1H3