N-(2-methylpropyl)-5-[[(phenylmethyl)-pyridin-3-ylcarbonyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(2-methylpropyl)-5-[[(phenylmethyl)-pyridin-3-ylcarbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[benzyl(pyridine-3-carbonyl)amino]methyl]-N-isobutyl-isoxazole-3-carboxamide CAS Name: N-(2-methylpropyl)-5-[[[oxo(3-pyridinyl)methyl]-(phenylmethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[[benzyl(pyridine-3-carbonyl)amino]methyl]-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[[benzyl(nicotinoyl)amino]methyl]-N-isobutyl-isoxazole-3-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NOC(=C1)CN(CC2=CC=CC=C2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C)CNC(=O)C1=NOC(=C1)CN(CC2=CC=CC=C2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H24N4O3/c1-16(2)12-24-21(27)20-11-19(29-25-20)15-26(14-17-7-4-3-5-8-17)22(28)18-9-6-10-23-13-18/h3-11,13,16H,12,14-15H2,1-2H3,(H,24,27)