2-bromanyl-1-but-2-ynyl-imidazole-4,5-dicarbonitrile

Systemtic Name: 2-bromanyl-1-but-2-ynyl-imidazole-4,5-dicarbonitrile Openeye Name: 2-bromo-1-but-2-ynyl-imidazole-4,5-dicarbonitrile CAS Name: 2-bromo-1-but-2-ynylimidazole-4,5-dicarbonitrile IUPAC Name: 2-bromo-1-but-2-ynylimidazole-4,5-dicarbonitrile Traditional Name: 2-bromo-1-but-2-ynyl-imidazole-4,5-dicarbonitrile Formula: C9H5BrN4 MolecularWeight: 249.0668

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCN1C(=C(N=C1Br)C#N)C#N

Isomeric SMILES

CC#CCN1C(=C(N=C1Br)C#N)C#N

InChI

InChI=1S/C9H5BrN4/c1-2-3-4-14-8(6-12)7(5-11)13-9(14)10/h4H2,1H3