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

Systemtic Name: 3-[4-(4-fluoranyl-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-phenyl-pyridazine Openeye Name: 3-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-phenyl-pyridazine CAS Name: 3-[4-(4-fluoro-3-methylphenyl)sulfonyl-1-piperazinyl]-6-phenylpyridazine IUPAC Name: 3-[4-(4-fluoro-3-methylphenyl)sulfonylpiperazin-1-yl]-6-phenylpyridazine Traditional Name: 3-[4-(4-fluoro-3-methyl-phenyl)sulfonylpiperazino]-6-phenyl-pyridazine Formula: C21H21FN4O2S MolecularWeight: 412.480443

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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=CC=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C21H21FN4O2S/c1-16-15-18(7-8-19(16)22)29(27,28)26-13-11-25(12-14-26)21-10-9-20(23-24-21)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3