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

Systemtic Name: 3-[4-(3-fluoranyl-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-6-pyridin-3-yl-pyridazine Openeye Name: 3-[4-(3-fluoro-4-methoxy-phenyl)sulfonylpiperazin-1-yl]-6-(3-pyridyl)pyridazine CAS Name: 3-[4-(3-fluoro-4-methoxyphenyl)sulfonyl-1-piperazinyl]-6-(3-pyridinyl)pyridazine IUPAC Name: 3-[4-(3-fluoro-4-methoxyphenyl)sulfonylpiperazin-1-yl]-6-pyridin-3-ylpyridazine Traditional Name: 3-[4-(3-fluoro-4-methoxy-phenyl)sulfonylpiperazino]-6-(3-pyridyl)pyridazine Formula: C20H20FN5O3S MolecularWeight: 429.467903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CN=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CN=CC=C4)F

InChI

InChI=1S/C20H20FN5O3S/c1-29-19-6-4-16(13-17(19)21)30(27,28)26-11-9-25(10-12-26)20-7-5-18(23-24-20)15-3-2-8-22-14-15/h2-8,13-14H,9-12H2,1H3