3-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[3-bromo-5-methoxy-4-(2-pyridinylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[3-bromo-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C25H21BrN4O2 MolecularWeight: 489.36384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC4=CC=CC=N4)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC(=C(C(=C3)Br)OCC4=CC=CC=N4)OC)C#N

InChI

InChI=1S/C25H21BrN4O2/c1-15-8-21-22(9-16(15)2)30-25(29-21)18(13-27)10-17-11-20(26)24(23(12-17)31-3)32-14-19-6-4-5-7-28-19/h4-12H,14H2,1-3H3,(H,29,30)