N-[4-(2-cyanopropan-2-yl)phenyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide

Systemtic Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide Openeye Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-3-(3-fluorophenyl)isoxazole-5-carboxamide CAS Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-(3-fluorophenyl)-5-isoxazolecarboxamide IUPAC Name: N-[4-(2-cyanopropan-2-yl)phenyl]-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide Traditional Name: N-[4-(1-cyano-1-methyl-ethyl)phenyl]-3-(3-fluorophenyl)isoxazole-5-carboxamide Formula: C20H16FN3O2 MolecularWeight: 349.358343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC(=NO2)C3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C#N)C1=CC=C(C=C1)NC(=O)C2=CC(=NO2)C3=CC(=CC=C3)F

InChI

InChI=1S/C20H16FN3O2/c1-20(2,12-22)14-6-8-16(9-7-14)23-19(25)18-11-17(24-26-18)13-4-3-5-15(21)10-13/h3-11H,1-2H3,(H,23,25)