1-[(3-bromanyl-4-methyl-phenyl)methyl]imidazole-4,5-dicarbonitrile

Systemtic Name: 1-[(3-bromanyl-4-methyl-phenyl)methyl]imidazole-4,5-dicarbonitrile Openeye Name: 1-[(3-bromo-4-methyl-phenyl)methyl]imidazole-4,5-dicarbonitrile CAS Name: 1-[(3-bromo-4-methylphenyl)methyl]imidazole-4,5-dicarbonitrile IUPAC Name: 1-[(3-bromo-4-methylphenyl)methyl]imidazole-4,5-dicarbonitrile Traditional Name: 1-(3-bromo-4-methyl-benzyl)imidazole-4,5-dicarbonitrile Formula: C13H9BrN4 MolecularWeight: 301.14136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CN2C=NC(=C2C#N)C#N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)CN2C=NC(=C2C#N)C#N)Br

InChI

InChI=1S/C13H9BrN4/c1-9-2-3-10(4-11(9)14)7-18-8-17-12(5-15)13(18)6-16/h2-4,8H,7H2,1H3