N-[(3-chlorophenyl)methyl]-5-[[(4-methylphenyl)carbonyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-5-[[(4-methylphenyl)carbonyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-5-[[1-ethylpropyl-(4-methylbenzoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-5-[[[(4-methylphenyl)-oxomethyl]-pentan-3-ylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-5-[[(4-methylbenzoyl)-pentan-3-ylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(3-chlorobenzyl)-5-[[1-ethylpropyl(p-toluoyl)amino]methyl]isoxazole-3-carboxamide Formula: C25H28ClN3O3 MolecularWeight: 453.96112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2=CC(=CC=C2)Cl)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC2=CC(=CC=C2)Cl)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H28ClN3O3/c1-4-21(5-2)29(25(31)19-11-9-17(3)10-12-19)16-22-14-23(28-32-22)24(30)27-15-18-7-6-8-20(26)13-18/h6-14,21H,4-5,15-16H2,1-3H3,(H,27,30)