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

Systemtic Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-(3-pyridylmethylamino)oxazole-4-carbonitrile CAS Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(3-pyridinylmethylamino)-4-oxazolecarbonitrile IUPAC Name: 2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(E)-2-(3,4-dimethoxyphenyl)vinyl]-5-(3-pyridylmethylamino)oxazole-4-carbonitrile Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC2=NC(=C(O2)NCC3=CN=CC=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C2=NC(=C(O2)NCC3=CN=CC=C3)C#N)OC

InChI

InChI=1S/C20H18N4O3/c1-25-17-7-5-14(10-18(17)26-2)6-8-19-24-16(11-21)20(27-19)23-13-15-4-3-9-22-12-15/h3-10,12,23H,13H2,1-2H3/b8-6+