4-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(3-methylquinolin-8-yl)sulfonylpiperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)C4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCN(CC3)C(=O)C4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C23H21N5O4S/c1-15-13-16-5-4-8-19(20(16)24-14-15)33(31,32)28-11-9-27(10-12-28)23(30)21-17-6-2-3-7-18(17)22(29)26-25-21/h2-8,13-14H,9-12H2,1H3,(H,26,29)