1-phenyl-4-[4-(phenylsulfonyl)piperazin-1-yl]phthalazine

Systemtic Name: 1-phenyl-4-[4-(phenylsulfonyl)piperazin-1-yl]phthalazine Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-phenyl-phthalazine CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-4-phenylphthalazine IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-4-phenylphthalazine Traditional Name: 1-(4-besylpiperazino)-4-phenyl-phthalazine Formula: C24H22N4O2S MolecularWeight: 430.52208

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C24H22N4O2S/c29-31(30,20-11-5-2-6-12-20)28-17-15-27(16-18-28)24-22-14-8-7-13-21(22)23(25-26-24)19-9-3-1-4-10-19/h1-14H,15-18H2