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

Systemtic Name: 2-propyl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonyl-phthalazin-1-one Openeye Name: 2-propyl-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-propyl-1-phthalazinone IUPAC Name: 2-propyl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phthalazin-1-one Traditional Name: 2-propyl-4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phthalazin-1-one Formula: C26H32N4O4S MolecularWeight: 496.62168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=C(C(=CC(=C4C)C)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCN(CC3)S(=O)(=O)C4=C(C(=CC(=C4C)C)C)C

InChI

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