5-[[(4-tert-butylphenyl)carbonyl-propyl-amino]methyl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[[(4-tert-butylphenyl)carbonyl-propyl-amino]methyl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[(4-tert-butylbenzoyl)-propyl-amino]methyl]-N-[(4-fluorophenyl)methyl]isoxazole-3-carboxamide CAS Name: 5-[[[(4-tert-butylphenyl)-oxomethyl]-propylamino]methyl]-N-[(4-fluorophenyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[[(4-tert-butylbenzoyl)-propylamino]methyl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(4-tert-butylbenzoyl)-propyl-amino]methyl]-N-(4-fluorobenzyl)isoxazole-3-carboxamide Formula: C26H30FN3O3 MolecularWeight: 451.533103

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=NO1)C(=O)NCC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCN(CC1=CC(=NO1)C(=O)NCC2=CC=C(C=C2)F)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H30FN3O3/c1-5-14-30(25(32)19-8-10-20(11-9-19)26(2,3)4)17-22-15-23(29-33-22)24(31)28-16-18-6-12-21(27)13-7-18/h6-13,15H,5,14,16-17H2,1-4H3,(H,28,31)