3-[6-bromanyl-3-[[5-(dimethylamino)-6-oxidanylidene-1H-pyridazin-3-yl]methyl]-2-fluoranyl-phenoxy]-4-chloranyl-benzenecarbonitrile

Systemtic Name: 3-[6-bromanyl-3-[[5-(dimethylamino)-6-oxidanylidene-1H-pyridazin-3-yl]methyl]-2-fluoranyl-phenoxy]-4-chloranyl-benzenecarbonitrile Openeye Name: 3-[6-bromo-3-[[5-(dimethylamino)-6-oxo-1H-pyridazin-3-yl]methyl]-2-fluoro-phenoxy]-4-chloro-benzonitrile CAS Name: 3-[6-bromo-3-[[5-(dimethylamino)-6-oxo-1H-pyridazin-3-yl]methyl]-2-fluorophenoxy]-4-chlorobenzonitrile IUPAC Name: 3-[6-bromo-3-[[5-(dimethylamino)-6-oxo-1H-pyridazin-3-yl]methyl]-2-fluorophenoxy]-4-chlorobenzonitrile Traditional Name: 3-[6-bromo-3-[[5-(dimethylamino)-6-keto-1H-pyridazin-3-yl]methyl]-2-fluoro-phenoxy]-4-chloro-benzonitrile Formula: C20H15BrClFN4O2 MolecularWeight: 477.714103

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=NNC1=O)CC2=C(C(=C(C=C2)Br)OC3=C(C=CC(=C3)C#N)Cl)F

Isomeric SMILES

CN(C)C1=CC(=NNC1=O)CC2=C(C(=C(C=C2)Br)OC3=C(C=CC(=C3)C#N)Cl)F

InChI

InChI=1S/C20H15BrClFN4O2/c1-27(2)16-9-13(25-26-20(16)28)8-12-4-5-14(21)19(18(12)23)29-17-7-11(10-24)3-6-15(17)22/h3-7,9H,8H2,1-2H3,(H,26,28)