3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2,4,5-trimethylphenyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2,4,5-trimethylphenyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2,4,5-trimethylphenyl)sulfonylpiperazin-1-yl]pyridazine CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)-6-[4-(2,4,5-trimethylphenyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2,4,5-trimethylphenyl)sulfonylpiperazin-1-yl]pyridazine Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)-6-[4-(2,4,5-trimethylphenyl)sulfonylpiperazino]pyridazine Formula: C22H28N6O2S MolecularWeight: 440.56172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C(=CC(=N4)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C(=CC(=N4)C)C)C

InChI

InChI=1S/C22H28N6O2S/c1-15-12-17(3)20(13-16(15)2)31(29,30)27-10-8-26(9-11-27)21-6-7-22(24-23-21)28-19(5)14-18(4)25-28/h6-7,12-14H,8-11H2,1-5H3