5-[[methyl-(phenylmethyl)amino]methyl]-N-(quinolin-3-ylmethyl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[[methyl-(phenylmethyl)amino]methyl]-N-(quinolin-3-ylmethyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[[benzyl(methyl)amino]methyl]-N-(3-quinolylmethyl)isoxazole-3-carboxamide CAS Name: 5-[[methyl-(phenylmethyl)amino]methyl]-N-(3-quinolinylmethyl)-3-isoxazolecarboxamide IUPAC Name: 5-[[benzyl(methyl)amino]methyl]-N-(quinolin-3-ylmethyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[[benzyl(methyl)amino]methyl]-N-(3-quinolylmethyl)isoxazole-3-carboxamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NCC3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)CC2=CC(=NO2)C(=O)NCC3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C23H22N4O2/c1-27(15-17-7-3-2-4-8-17)16-20-12-22(26-29-20)23(28)25-14-18-11-19-9-5-6-10-21(19)24-13-18/h2-13H,14-16H2,1H3,(H,25,28)