N-[5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)pyridin-3-yl]-1,2-oxazole-4-carboxamide

Systemtic Name: N-[5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)pyridin-3-yl]-1,2-oxazole-4-carboxamide Openeye Name: N-[5-(aminomethyl)-6-isobutyl-2-methyl-4-(p-tolyl)-3-pyridyl]isoxazole-4-carboxamide CAS Name: N-[5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-3-pyridinyl]-4-isoxazolecarboxamide IUPAC Name: N-[5-(aminomethyl)-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)pyridin-3-yl]-1,2-oxazole-4-carboxamide Traditional Name: N-[5-(aminomethyl)-6-isobutyl-2-methyl-4-(p-tolyl)-3-pyridyl]isoxazole-4-carboxamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=C2NC(=O)C3=CON=C3)C)CC(C)C)CN

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=C2NC(=O)C3=CON=C3)C)CC(C)C)CN

InChI

InChI=1S/C22H26N4O2/c1-13(2)9-19-18(10-23)20(16-7-5-14(3)6-8-16)21(15(4)25-19)26-22(27)17-11-24-28-12-17/h5-8,11-13H,9-10,23H2,1-4H3,(H,26,27)