2-propan-2-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one

Systemtic Name: 2-propan-2-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-isopropyl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[oxo-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 2-propan-2-yl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-isopropyl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phthalazin-1-one Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C)C

InChI

InChI=1S/C26H32N4O4S/c1-16(2)30-25(31)22-10-8-7-9-21(22)23(27-30)26(32)28-11-13-29(14-12-28)35(33,34)24-19(5)17(3)15-18(4)20(24)6/h7-10,15-16H,11-14H2,1-6H3