4-methyl-2-[2-oxidanylidene-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethyl]phthalazin-1-one Openeye Name: 4-methyl-2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethyl]phthalazin-1-one CAS Name: 4-methyl-2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]ethyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[2-oxo-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]ethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]ethyl]-4-methyl-phthalazin-1-one Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C)C)C

InChI

InChI=1S/C25H30N4O4S/c1-16-14-17(2)19(4)24(18(16)3)34(32,33)28-12-10-27(11-13-28)23(30)15-29-25(31)22-9-7-6-8-21(22)20(5)26-29/h6-9,14H,10-13,15H2,1-5H3