2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-(3-imidazol-1-ylpropylamino)oxazole-4-carbonitrile CAS Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[3-(1-imidazolyl)propylamino]-4-oxazolecarbonitrile IUPAC Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(3-imidazol-1-ylpropylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-(3-imidazol-1-ylpropylamino)oxazole-4-carbonitrile Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC2=NC(=C(O2)NCCCN3C=CN=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C2=NC(=C(O2)NCCCN3C=CN=C3)C#N)OC

InChI

InChI=1S/C20H21N5O3/c1-26-17-6-4-15(12-18(17)27-2)5-7-19-24-16(13-21)20(28-19)23-8-3-10-25-11-9-22-14-25/h4-7,9,11-12,14,23H,3,8,10H2,1-2H3/b7-5+