3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-6-(phenylsulfonyl)pyridazine

Systemtic Name: 3-[4-(2,4-dimethylphenyl)piperazin-1-yl]-6-(phenylsulfonyl)pyridazine Openeye Name: 3-(benzenesulfonyl)-6-[4-(2,4-dimethylphenyl)piperazin-1-yl]pyridazine CAS Name: 3-(benzenesulfonyl)-6-[4-(2,4-dimethylphenyl)-1-piperazinyl]pyridazine IUPAC Name: 3-(benzenesulfonyl)-6-[4-(2,4-dimethylphenyl)piperazin-1-yl]pyridazine Traditional Name: 3-besyl-6-[4-(2,4-dimethylphenyl)piperazino]pyridazine Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C3=NN=C(C=C3)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C3=NN=C(C=C3)S(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N4O2S/c1-17-8-9-20(18(2)16-17)25-12-14-26(15-13-25)21-10-11-22(24-23-21)29(27,28)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3