N-[[4-[4-(4-cyanopyrazol-1-yl)phenyl]-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide

Systemtic Name: N-[[4-[4-(4-cyanopyrazol-1-yl)phenyl]-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide Openeye Name: N-[[4-[4-(4-cyanopyrazol-1-yl)phenyl]-5-oxo-isoxazol-2-yl]methyl]acetamide CAS Name: N-[[4-[4-(4-cyano-1-pyrazolyl)phenyl]-5-oxo-2-isoxazolyl]methyl]acetamide IUPAC Name: N-[[4-[4-(4-cyanopyrazol-1-yl)phenyl]-5-oxo-1,2-oxazol-2-yl]methyl]acetamide Traditional Name: N-[[4-[4-(4-cyanopyrazol-1-yl)phenyl]-5-keto-3-isoxazolin-2-yl]methyl]acetamide Formula: C16H13N5O3 MolecularWeight: 323.30612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3C=C(C=N3)C#N

Isomeric SMILES

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3C=C(C=N3)C#N

InChI

InChI=1S/C16H13N5O3/c1-11(22)18-10-20-9-15(16(23)24-20)13-2-4-14(5-3-13)21-8-12(6-17)7-19-21/h2-5,7-9H,10H2,1H3,(H,18,22)