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

Systemtic Name: 5-[[(4-tert-butylphenyl)carbonyl-cyclohexyl-amino]methyl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[(4-tert-butylbenzoyl)-cyclohexyl-amino]methyl]-N-[(4-fluorophenyl)methyl]isoxazole-3-carboxamide CAS Name: 5-[[[(4-tert-butylphenyl)-oxomethyl]-cyclohexylamino]methyl]-N-[(4-fluorophenyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[[(4-tert-butylbenzoyl)-cyclohexylamino]methyl]-N-[(4-fluorophenyl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(4-tert-butylbenzoyl)-cyclohexyl-amino]methyl]-N-(4-fluorobenzyl)isoxazole-3-carboxamide Formula: C29H34FN3O3 MolecularWeight: 491.596963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)F)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC(=NO2)C(=O)NCC3=CC=C(C=C3)F)C4CCCCC4

InChI

InChI=1S/C29H34FN3O3/c1-29(2,3)22-13-11-21(12-14-22)28(35)33(24-7-5-4-6-8-24)19-25-17-26(32-36-25)27(34)31-18-20-9-15-23(30)16-10-20/h9-17,24H,4-8,18-19H2,1-3H3,(H,31,34)