3-(4-methylsulfonylphenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyridazine

Systemtic Name: 3-(4-methylsulfonylphenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyridazine Openeye Name: 3-(4-methylsulfonylphenyl)-6-[4-(1-piperidyl)-1-piperidyl]pyridazine CAS Name: 3-(4-methylsulfonylphenyl)-6-[4-(1-piperidinyl)-1-piperidinyl]pyridazine IUPAC Name: 3-(4-methylsulfonylphenyl)-6-(4-piperidin-1-ylpiperidin-1-yl)pyridazine Traditional Name: 3-(4-mesylphenyl)-6-(4-piperidinopiperidino)pyridazine Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NN=C(C=C2)N3CCC(CC3)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NN=C(C=C2)N3CCC(CC3)N4CCCCC4

InChI

InChI=1S/C21H28N4O2S/c1-28(26,27)19-7-5-17(6-8-19)20-9-10-21(23-22-20)25-15-11-18(12-16-25)24-13-3-2-4-14-24/h5-10,18H,2-4,11-16H2,1H3