4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-pentyl-phthalazin-1-one

Systemtic Name: 4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-pentyl-phthalazin-1-one Openeye Name: 2-pentyl-4-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]phthalazin-1-one CAS Name: 4-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-pentyl-1-phthalazinone IUPAC Name: 4-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]-2-pentylphthalazin-1-one Traditional Name: 2-amyl-4-(4-tosylpiperazine-1-carbonyl)phthalazin-1-one Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H30N4O4S/c1-3-4-7-14-29-24(30)22-9-6-5-8-21(22)23(26-29)25(31)27-15-17-28(18-16-27)34(32,33)20-12-10-19(2)11-13-20/h5-6,8-13H,3-4,7,14-18H2,1-2H3