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

Systemtic Name: 5-[[(4-methylphenyl)carbonyl-(pyridin-4-ylmethyl)amino]methyl]-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide Openeye Name: N-isobutyl-5-[[(4-methylbenzoyl)-(4-pyridylmethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: 5-[[[(4-methylphenyl)-oxomethyl]-(pyridin-4-ylmethyl)amino]methyl]-N-(2-methylpropyl)-3-isoxazolecarboxamide IUPAC Name: 5-[[(4-methylbenzoyl)-(pyridin-4-ylmethyl)amino]methyl]-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: N-isobutyl-5-[[p-toluoyl(4-pyridylmethyl)amino]methyl]isoxazole-3-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=NC=C2)CC3=CC(=NO3)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=NC=C2)CC3=CC(=NO3)C(=O)NCC(C)C

InChI

InChI=1S/C23H26N4O3/c1-16(2)13-25-22(28)21-12-20(30-26-21)15-27(14-18-8-10-24-11-9-18)23(29)19-6-4-17(3)5-7-19/h4-12,16H,13-15H2,1-3H3,(H,25,28)