4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one

Systemtic Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propan-2-yl-phthalazin-1-one Openeye Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one CAS Name: 4-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-propan-2-yl-1-phthalazinone IUPAC Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-propan-2-ylphthalazin-1-one Traditional Name: 4-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-isopropyl-phthalazin-1-one Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C26H32N4O4S/c1-18(2)30-24(31)22-9-7-6-8-21(22)23(27-30)25(32)28-14-16-29(17-15-28)35(33,34)20-12-10-19(11-13-20)26(3,4)5/h6-13,18H,14-17H2,1-5H3