2-(6-methyl-1H-benzimidazol-2-yl)-3-(3-methyl-4-morpholin-4-yl-phenyl)prop-2-enenitrile

Systemtic Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(3-methyl-4-morpholin-4-yl-phenyl)prop-2-enenitrile Openeye Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(3-methyl-4-morpholino-phenyl)prop-2-enenitrile CAS Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-[3-methyl-4-(4-morpholinyl)phenyl]-2-propenenitrile IUPAC Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(3-methyl-4-morpholin-4-ylphenyl)prop-2-enenitrile Traditional Name: 2-(6-methyl-1H-benzimidazol-2-yl)-3-(3-methyl-4-morpholino-phenyl)acrylonitrile Formula: C22H22N4O MolecularWeight: 358.43628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)N4CCOCC4)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC(=C(C=C3)N4CCOCC4)C)C#N

InChI

InChI=1S/C22H22N4O/c1-15-3-5-19-20(11-15)25-22(24-19)18(14-23)13-17-4-6-21(16(2)12-17)26-7-9-27-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,24,25)