4-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one

Systemtic Name: 4-[2-oxidanylidene-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one Openeye Name: 4-[2-oxo-2-(4-tetralin-6-ylsulfonylpiperazin-1-yl)ethyl]-2H-phthalazin-1-one CAS Name: 4-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]ethyl]-2H-phthalazin-1-one IUPAC Name: 4-[2-oxo-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]ethyl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-2-(4-tetralin-6-ylsulfonylpiperazino)ethyl]-2H-phthalazin-1-one Formula: C24H26N4O4S MolecularWeight: 466.55264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CC4=NNC(=O)C5=CC=CC=C54

InChI

InChI=1S/C24H26N4O4S/c29-23(16-22-20-7-3-4-8-21(20)24(30)26-25-22)27-11-13-28(14-12-27)33(31,32)19-10-9-17-5-1-2-6-18(17)15-19/h3-4,7-10,15H,1-2,5-6,11-14,16H2,(H,26,30)