(Z)-2-(1H-benzimidazol-2-yl)-3-(2-methoxy-4-morpholin-4-yl-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(2-methoxy-4-morpholin-4-yl-phenyl)prop-2-enenitrile Openeye Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(2-methoxy-4-morpholino-phenyl)prop-2-enenitrile CAS Name: (Z)-2-(1H-benzimidazol-2-yl)-3-[2-methoxy-4-(4-morpholinyl)phenyl]-2-propenenitrile IUPAC Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(2-methoxy-4-morpholin-4-ylphenyl)prop-2-enenitrile Traditional Name: (Z)-2-(1H-benzimidazol-2-yl)-3-(2-methoxy-4-morpholino-phenyl)acrylonitrile Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCOCC2)C=C(C#N)C3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCOCC2)/C=C(/C#N)\C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H20N4O2/c1-26-20-13-17(25-8-10-27-11-9-25)7-6-15(20)12-16(14-22)21-23-18-4-2-3-5-19(18)24-21/h2-7,12-13H,8-11H2,1H3,(H,23,24)/b16-12-