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

Systemtic Name: 4-[4-[(3-cyano-2-oxidanyl-phenyl)methyl]phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: 4-[4-[(3-cyano-2-hydroxy-phenyl)methyl]phenyl]-3-(3-pyridyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: 4-[4-[(3-cyano-2-hydroxyphenyl)methyl]phenyl]-3-(3-pyridinyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: 4-[4-[(3-cyano-2-hydroxyphenyl)methyl]phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: 4-[4-(3-cyano-2-hydroxy-benzyl)phenyl]-3-(3-pyridyl)-2-isoxazoline-5-carboxamide Formula: C23H18N4O3 MolecularWeight: 398.41402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CC2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N)O)C#N

Isomeric SMILES

C1=CC(=C(C(=C1)CC2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N)O)C#N

InChI

InChI=1S/C23H18N4O3/c24-12-17-4-1-3-16(21(17)28)11-14-6-8-15(9-7-14)19-20(18-5-2-10-26-13-18)27-30-22(19)23(25)29/h1-10,13,19,22,28H,11H2,(H2,25,29)