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

Systemtic Name: 5-(1-phenylethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Openeye Name: 5-(1-phenylethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]oxazole-4-carbonitrile CAS Name: 5-(1-phenylethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-4-oxazolecarbonitrile IUPAC Name: 5-(1-phenylethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]-1,3-oxazole-4-carbonitrile Traditional Name: 5-(1-phenylethylamino)-2-[(2,4,6-trimethylphenoxy)methyl]oxazole-4-carbonitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O2/c1-14-10-15(2)21(16(3)11-14)26-13-20-25-19(12-23)22(27-20)24-17(4)18-8-6-5-7-9-18/h5-11,17,24H,13H2,1-4H3