4-[1-[(7-bromanyl-2,3-dimethyl-1-benzofuran-4-yl)methyl]imidazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[1-[(7-bromanyl-2,3-dimethyl-1-benzofuran-4-yl)methyl]imidazol-4-yl]benzenecarbonitrile Openeye Name: 4-[1-[(7-bromo-2,3-dimethyl-benzofuran-4-yl)methyl]imidazol-4-yl]benzonitrile CAS Name: 4-[1-[(7-bromo-2,3-dimethyl-4-benzofuranyl)methyl]-4-imidazolyl]benzonitrile IUPAC Name: 4-[1-[(7-bromo-2,3-dimethyl-1-benzofuran-4-yl)methyl]imidazol-4-yl]benzonitrile Traditional Name: 4-[1-[(7-bromo-2,3-dimethyl-benzofuran-4-yl)methyl]imidazol-4-yl]benzonitrile Formula: C21H16BrN3O MolecularWeight: 406.27524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=CC(=C12)CN3C=C(N=C3)C4=CC=C(C=C4)C#N)Br)C

Isomeric SMILES

CC1=C(OC2=C(C=CC(=C12)CN3C=C(N=C3)C4=CC=C(C=C4)C#N)Br)C

InChI

InChI=1S/C21H16BrN3O/c1-13-14(2)26-21-18(22)8-7-17(20(13)21)10-25-11-19(24-12-25)16-5-3-15(9-23)4-6-16/h3-8,11-12H,10H2,1-2H3