4-[(2-bromanyl-3-but-2-ynyl-4-oxidanylidene-imidazo[4,5-d]pyridazin-5-yl)methyl]naphthalene-1-carbonitrile

Systemtic Name: 4-[(2-bromanyl-3-but-2-ynyl-4-oxidanylidene-imidazo[4,5-d]pyridazin-5-yl)methyl]naphthalene-1-carbonitrile Openeye Name: 4-[(2-bromo-3-but-2-ynyl-4-oxo-imidazo[4,5-d]pyridazin-5-yl)methyl]naphthalene-1-carbonitrile CAS Name: 4-[(2-bromo-3-but-2-ynyl-4-oxo-5-imidazo[4,5-d]pyridazinyl)methyl]-1-naphthalenecarbonitrile IUPAC Name: 4-[(2-bromo-3-but-2-ynyl-4-oxoimidazo[4,5-d]pyridazin-5-yl)methyl]naphthalene-1-carbonitrile Traditional Name: 4-[(2-bromo-3-but-2-ynyl-4-keto-imidazo[4,5-d]pyridazin-5-yl)methyl]naphthalene-1-carbonitrile Formula: C21H14BrN5O MolecularWeight: 432.27276

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C2=C(C=NN(C2=O)CC3=CC=C(C4=CC=CC=C34)C#N)N=C1Br

Isomeric SMILES

CC#CCN1C2=C(C=NN(C2=O)CC3=CC=C(C4=CC=CC=C34)C#N)N=C1Br

InChI

InChI=1S/C21H14BrN5O/c1-2-3-10-26-19-18(25-21(26)22)12-24-27(20(19)28)13-15-9-8-14(11-23)16-6-4-5-7-17(15)16/h4-9,12H,10,13H2,1H3