5-(pyridin-3-ylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(pyridin-3-ylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-pyridylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-(3-pyridinylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(pyridin-3-ylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-pyridylmethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]oxazole-4-carbonitrile Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC2=NC(=C(O2)NCC3=CN=CC=C3)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC2=NC(=C(O2)NCC3=CN=CC=C3)C#N)C

InChI

InChI=1S/C20H20N4O2/c1-13-7-14(2)19(15(3)8-13)25-12-18-24-17(9-21)20(26-18)23-11-16-5-4-6-22-10-16/h4-8,10,23H,11-12H2,1-3H3