3-(4-chlorophenyl)-6-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]pyridazine

Systemtic Name: 3-(4-chlorophenyl)-6-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]pyridazine Openeye Name: 3-(4-chlorophenyl)-6-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazin-1-yl]pyridazine CAS Name: 3-(4-chlorophenyl)-6-[4-(4-fluoro-3-methylphenyl)sulfonyl-1-piperazinyl]pyridazine IUPAC Name: 3-(4-chlorophenyl)-6-[4-(4-fluoro-3-methylphenyl)sulfonylpiperazin-1-yl]pyridazine Traditional Name: 3-(4-chlorophenyl)-6-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazino]pyridazine Formula: C21H20ClFN4O2S MolecularWeight: 446.925503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=C(C=C4)Cl)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C21H20ClFN4O2S/c1-15-14-18(6-7-19(15)23)30(28,29)27-12-10-26(11-13-27)21-9-8-20(24-25-21)16-2-4-17(22)5-3-16/h2-9,14H,10-13H2,1H3