4-(4-methylsulfonylpiperazin-1-yl)carbonyl-2-phenyl-phthalazin-1-one

Systemtic Name: 4-(4-methylsulfonylpiperazin-1-yl)carbonyl-2-phenyl-phthalazin-1-one Openeye Name: 4-(4-methylsulfonylpiperazine-1-carbonyl)-2-phenyl-phthalazin-1-one CAS Name: 4-[(4-methylsulfonyl-1-piperazinyl)-oxomethyl]-2-phenyl-1-phthalazinone IUPAC Name: 4-(4-methylsulfonylpiperazine-1-carbonyl)-2-phenylphthalazin-1-one Traditional Name: 4-(4-mesylpiperazine-1-carbonyl)-2-phenyl-phthalazin-1-one Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O4S/c1-29(27,28)23-13-11-22(12-14-23)20(26)18-16-9-5-6-10-17(16)19(25)24(21-18)15-7-3-2-4-8-15/h2-10H,11-14H2,1H3