4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one Openeye Name: 4-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one CAS Name: 4-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2-propan-2-ylphthalazin-1-one Traditional Name: 4-[4-(2,4-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one Formula: C24H28N4O4S MolecularWeight: 468.56852

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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)C(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H28N4O4S/c1-16(2)28-23(29)20-8-6-5-7-19(20)22(25-28)24(30)26-11-13-27(14-12-26)33(31,32)21-10-9-17(3)15-18(21)4/h5-10,15-16H,11-14H2,1-4H3