N-(3-methylbutyl)-2-[[3-methylbutyl(2-thiophen-2-ylethanoyl)amino]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-[[3-methylbutyl(2-thiophen-2-ylethanoyl)amino]methyl]-1,3-oxazole-4-carboxamide Openeye Name: N-isopentyl-2-[[isopentyl-[2-(2-thienyl)acetyl]amino]methyl]oxazole-4-carboxamide CAS Name: N-(3-methylbutyl)-2-[[3-methylbutyl-(1-oxo-2-thiophen-2-ylethyl)amino]methyl]-4-oxazolecarboxamide IUPAC Name: N-(3-methylbutyl)-2-[[3-methylbutyl-(2-thiophen-2-ylacetyl)amino]methyl]-1,3-oxazole-4-carboxamide Traditional Name: N-isoamyl-2-[[isoamyl-[2-(2-thienyl)acetyl]amino]methyl]oxazole-4-carboxamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=COC(=N1)CN(CCC(C)C)C(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)CCNC(=O)C1=COC(=N1)CN(CCC(C)C)C(=O)CC2=CC=CS2

InChI

InChI=1S/C21H31N3O3S/c1-15(2)7-9-22-21(26)18-14-27-19(23-18)13-24(10-8-16(3)4)20(25)12-17-6-5-11-28-17/h5-6,11,14-16H,7-10,12-13H2,1-4H3,(H,22,26)