3-[3,5-bis(bromanyl)-4-prop-2-ynoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[3,5-bis(bromanyl)-4-prop-2-ynoxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-(3,5-dibromo-4-prop-2-ynoxy-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-(3,5-dibromo-4-prop-2-ynoxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-(3,5-dibromo-4-prop-2-ynoxyphenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-(3,5-dibromo-4-propargyloxy-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C20H13Br2N3O MolecularWeight: 471.14472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC#C)Br)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC#C)Br)C#N

InChI

InChI=1S/C20H13Br2N3O/c1-3-6-26-19-15(21)9-13(10-16(19)22)8-14(11-23)20-24-17-5-4-12(2)7-18(17)25-20/h1,4-5,7-10H,6H2,2H3,(H,24,25)