N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)carbonyl-phenethyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylphenyl)carbonyl-phenethyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylbenzoyl)-phenethyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-5-[[[(4-methylphenyl)-oxomethyl]-phenethylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-5-[[(4-methylbenzoyl)-phenethylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-5-[[phenethyl(p-toluoyl)amino]methyl]isoxazole-3-carboxamide Formula: C28H26FN3O3 MolecularWeight: 471.522743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCC2=CC=CC=C2)CC3=CC(=NO3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C28H26FN3O3/c1-20-7-11-23(12-8-20)28(34)32(16-15-21-5-3-2-4-6-21)19-25-17-26(31-35-25)27(33)30-18-22-9-13-24(29)14-10-22/h2-14,17H,15-16,18-19H2,1H3,(H,30,33)