N-[(4-methylphenyl)methyl]-5-[[oxolan-2-ylmethyl(pyridin-3-ylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-5-[[oxolan-2-ylmethyl(pyridin-3-ylcarbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(p-tolylmethyl)-5-[[pyridine-3-carbonyl(tetrahydrofuran-2-ylmethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-5-[[2-oxolanylmethyl-[oxo(3-pyridinyl)methyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-5-[[oxolan-2-ylmethyl(pyridine-3-carbonyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(4-methylbenzyl)-5-[[nicotinoyl(tetrahydrofurfuryl)amino]methyl]isoxazole-3-carboxamide Formula: C24H26N4O4 MolecularWeight: 434.48764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC3CCCO3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC3CCCO3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H26N4O4/c1-17-6-8-18(9-7-17)13-26-23(29)22-12-21(32-27-22)16-28(15-20-5-3-11-31-20)24(30)19-4-2-10-25-14-19/h2,4,6-10,12,14,20H,3,5,11,13,15-16H2,1H3,(H,26,29)