N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carboxamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carboxamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-1-(2-fluorophenyl)-4-keto-6-methyl-pyridazine-3-carboxamide Formula: C22H21BrFN3O4 MolecularWeight: 490.322243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCCC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C22H21BrFN3O4/c1-13-10-18(28)21(26-27(13)17-7-5-4-6-16(17)24)22(29)25-9-8-14-11-19(30-2)20(31-3)12-15(14)23/h4-7,10-12H,8-9H2,1-3H3,(H,25,29)