4-[4-(1-cyano-2-oxidanyl-1-phenyl-ethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: 4-[4-(1-cyano-2-oxidanyl-1-phenyl-ethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 4-[4-(1-cyano-2-hydroxy-1-phenyl-ethyl)phenyl]-3-(3-pyridyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: 4-[4-(1-cyano-2-hydroxy-1-phenylethyl)phenyl]-3-(3-pyridinyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 4-[4-(1-cyano-2-hydroxy-1-phenylethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 4-[4-(1-cyano-2-hydroxy-1-phenyl-ethyl)phenyl]-3-(3-pyridyl)-2-isoxazoline-5-carboxamide Formula: C24H20N4O3 MolecularWeight: 412.4406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)(C#N)C2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(CO)(C#N)C2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N

InChI

InChI=1S/C24H20N4O3/c25-14-24(15-29,18-6-2-1-3-7-18)19-10-8-16(9-11-19)20-21(17-5-4-12-27-13-17)28-31-22(20)23(26)30/h1-13,20,22,29H,15H2,(H2,26,30)