2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[[6-(4-ethoxyphenyl)-3-pyridazinyl]thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[6-(4-ethoxyphenyl)pyridazin-3-yl]sulfanyl-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[(6-p-phenetylpyridazin-3-yl)thio]acetamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O2S/c1-2-27-18-9-5-16(6-10-18)19-11-12-21(25-24-19)28-14-20(26)23-13-15-3-7-17(22)8-4-15/h3-12H,2,13-14H2,1H3,(H,23,26)