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

Systemtic Name: 2-[(2,4-dimethylphenoxy)methyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(2,4-dimethylphenoxy)methyl]-5-(3-pyridylmethylamino)oxazole-4-carbonitrile CAS Name: 2-[(2,4-dimethylphenoxy)methyl]-5-(3-pyridinylmethylamino)-4-oxazolecarbonitrile IUPAC Name: 2-[(2,4-dimethylphenoxy)methyl]-5-(pyridin-3-ylmethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(2,4-dimethylphenoxy)methyl]-5-(3-pyridylmethylamino)oxazole-4-carbonitrile Formula: C19H18N4O2 MolecularWeight: 334.37182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O2/c1-13-5-6-17(14(2)8-13)24-12-18-23-16(9-20)19(25-18)22-11-15-4-3-7-21-10-15/h3-8,10,22H,11-12H2,1-2H3