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

Systemtic Name: 2-[(3-chloranylphenoxy)methyl]-5-(pyridin-4-ylmethylamino)-1,3-oxazole-4-carbonitrile Openeye Name: 2-[(3-chlorophenoxy)methyl]-5-(4-pyridylmethylamino)oxazole-4-carbonitrile CAS Name: 2-[(3-chlorophenoxy)methyl]-5-(pyridin-4-ylmethylamino)-4-oxazolecarbonitrile IUPAC Name: 2-[(3-chlorophenoxy)methyl]-5-(pyridin-4-ylmethylamino)-1,3-oxazole-4-carbonitrile Traditional Name: 2-[(3-chlorophenoxy)methyl]-5-(4-pyridylmethylamino)oxazole-4-carbonitrile Formula: C17H13ClN4O2 MolecularWeight: 340.76372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O2/c18-13-2-1-3-14(8-13)23-11-16-22-15(9-19)17(24-16)21-10-12-4-6-20-7-5-12/h1-8,21H,10-11H2