2-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[3-(3,4-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[3-(3,4-dimethoxyphenyl)-6-oxo-1-pyridazinyl]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[3-(3,4-dimethoxyphenyl)-6-keto-pyridazin-1-yl]-N-(4-fluorobenzyl)acetamide Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NCC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H20FN3O4/c1-28-18-9-5-15(11-19(18)29-2)17-8-10-21(27)25(24-17)13-20(26)23-12-14-3-6-16(22)7-4-14/h3-11H,12-13H2,1-2H3,(H,23,26)