3-(2,4-dimethylphenyl)-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyridazine

Systemtic Name: 3-(2,4-dimethylphenyl)-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyridazine Openeye Name: 3-(2,4-dimethylphenyl)-6-[4-(3-pyridylsulfonyl)piperazin-1-yl]pyridazine CAS Name: 3-(2,4-dimethylphenyl)-6-[4-(3-pyridinylsulfonyl)-1-piperazinyl]pyridazine IUPAC Name: 3-(2,4-dimethylphenyl)-6-(4-pyridin-3-ylsulfonylpiperazin-1-yl)pyridazine Traditional Name: 3-(2,4-dimethylphenyl)-6-[4-(3-pyridylsulfonyl)piperazino]pyridazine Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)C

InChI

InChI=1S/C21H23N5O2S/c1-16-5-6-19(17(2)14-16)20-7-8-21(24-23-20)25-10-12-26(13-11-25)29(27,28)18-4-3-9-22-15-18/h3-9,14-15H,10-13H2,1-2H3