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

Systemtic Name: 5-[[(4-methylphenyl)carbonyl-pentan-3-yl-amino]methyl]-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide Openeye Name: 5-[[1-ethylpropyl-(4-methylbenzoyl)amino]methyl]-N-isobutyl-isoxazole-3-carboxamide CAS Name: 5-[[[(4-methylphenyl)-oxomethyl]-pentan-3-ylamino]methyl]-N-(2-methylpropyl)-3-isoxazolecarboxamide IUPAC Name: 5-[[(4-methylbenzoyl)-pentan-3-ylamino]methyl]-N-(2-methylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-[[1-ethylpropyl(p-toluoyl)amino]methyl]-N-isobutyl-isoxazole-3-carboxamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC(C)C)C(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(CC)N(CC1=CC(=NO1)C(=O)NCC(C)C)C(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H31N3O3/c1-6-18(7-2)25(22(27)17-10-8-16(5)9-11-17)14-19-12-20(24-28-19)21(26)23-13-15(3)4/h8-12,15,18H,6-7,13-14H2,1-5H3,(H,23,26)