N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]-5-(p-tolyl)isoxazole-3-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]-5-(4-methylphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[2-methyl-1-(3-pyridylmethylcarbamoyl)propyl]-5-(p-tolyl)isoxazole-3-carboxamide Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC(C(C)C)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC(C(C)C)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C22H24N4O3/c1-14(2)20(22(28)24-13-16-5-4-10-23-12-16)25-21(27)18-11-19(29-26-18)17-8-6-15(3)7-9-17/h4-12,14,20H,13H2,1-3H3,(H,24,28)(H,25,27)