3-(2-methylphenyl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-(2-methylphenyl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-(4-benzylsulfonylpiperazin-1-yl)-6-(o-tolyl)pyridazine CAS Name: 3-(2-methylphenyl)-6-[4-(phenylmethyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-(4-benzylsulfonylpiperazin-1-yl)-6-(2-methylphenyl)pyridazine Traditional Name: 3-(4-benzylsulfonylpiperazino)-6-(o-tolyl)pyridazine Formula: C22H24N4O2S MolecularWeight: 408.51656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2S/c1-18-7-5-6-10-20(18)21-11-12-22(24-23-21)25-13-15-26(16-14-25)29(27,28)17-19-8-3-2-4-9-19/h2-12H,13-17H2,1H3