5-(phenethylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(phenethylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(phenethylamino)-2-(4-propoxyphenyl)oxazole-4-carbonitrile CAS Name: 5-(phenethylamino)-2-(4-propoxyphenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(phenethylamino)-2-(4-propoxyphenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(phenethylamino)-2-(4-propoxyphenyl)oxazole-4-carbonitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)NCCC3=CC=CC=C3)C#N

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC(=C(O2)NCCC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H21N3O2/c1-2-14-25-18-10-8-17(9-11-18)20-24-19(15-22)21(26-20)23-13-12-16-6-4-3-5-7-16/h3-11,23H,2,12-14H2,1H3