2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]benzonitrile CAS Name: 2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-1-benzimidazolyl]methyl]benzonitrile IUPAC Name: 2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propylbenzimidazol-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-methyl-6-(5-methyl-1,3-benzoxazol-2-yl)-2-propyl-benzimidazol-1-yl]methyl]benzonitrile Formula: C27H24N4O MolecularWeight: 420.50566

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC=C3C#N)C4=NC5=C(O4)C=CC(=C5)C)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2N1CC3=CC=CC=C3C#N)C4=NC5=C(O4)C=CC(=C5)C)C

InChI

InChI=1S/C27H24N4O/c1-4-7-25-30-26-18(3)13-21(27-29-22-12-17(2)10-11-24(22)32-27)14-23(26)31(25)16-20-9-6-5-8-19(20)15-28/h5-6,8-14H,4,7,16H2,1-3H3