2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]phthalazin-1-one

Systemtic Name: 2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]phthalazin-1-one Openeye Name: 2-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]phthalazin-1-one CAS Name: 2-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]-1-phthalazinone IUPAC Name: 2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]phthalazin-1-one Traditional Name: 2-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]phthalazin-1-one Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C(=O)C3=CC=CC=C3C=N2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C(=O)C3=CC=CC=C3C=N2)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H22N4O4S/c29-23(17-28-24(30)22-8-4-3-7-20(22)16-25-28)26-11-13-27(14-12-26)33(31,32)21-10-9-18-5-1-2-6-19(18)15-21/h1-10,15-16H,11-14,17H2