3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonylpiperazin-1-yl)pyridazine

Systemtic Name: 3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonylpiperazin-1-yl)pyridazine Openeye Name: 3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonylpiperazin-1-yl)pyridazine CAS Name: 3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonyl-1-piperazinyl)pyridazine IUPAC Name: 3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonylpiperazin-1-yl)pyridazine Traditional Name: 3-(3,4-dimethylphenyl)-6-(4-phenethylsulfonylpiperazino)pyridazine Formula: C24H28N4O2S MolecularWeight: 436.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)CCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)CCC4=CC=CC=C4)C

InChI

InChI=1S/C24H28N4O2S/c1-19-8-9-22(18-20(19)2)23-10-11-24(26-25-23)27-13-15-28(16-14-27)31(29,30)17-12-21-6-4-3-5-7-21/h3-11,18H,12-17H2,1-2H3