3-(5-bromanyl-2-ethoxy-phenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-(5-bromanyl-2-ethoxy-phenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-(5-bromo-2-ethoxy-phenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-(5-bromo-2-ethoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-(5-bromo-2-ethoxyphenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-(5-bromo-2-ethoxy-phenyl)-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C20H18BrN3O MolecularWeight: 396.28042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC3=C(N2)C=C(C(=C3)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC3=C(N2)C=C(C(=C3)C)C

InChI

InChI=1S/C20H18BrN3O/c1-4-25-19-6-5-16(21)10-14(19)9-15(11-22)20-23-17-7-12(2)13(3)8-18(17)24-20/h5-10H,4H2,1-3H3,(H,23,24)