5-[[3-cyclopentylpropanoyl(thiophen-2-ylmethyl)amino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[[3-cyclopentylpropanoyl(thiophen-2-ylmethyl)amino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[[3-cyclopentylpropanoyl(2-thienylmethyl)amino]methyl]-N-(p-tolylmethyl)isoxazole-3-carboxamide CAS Name: 5-[[(3-cyclopentyl-1-oxopropyl)-(thiophen-2-ylmethyl)amino]methyl]-N-[(4-methylphenyl)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[[3-cyclopentylpropanoyl(thiophen-2-ylmethyl)amino]methyl]-N-[(4-methylphenyl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[3-cyclopentylpropanoyl(2-thenyl)amino]methyl]-N-(4-methylbenzyl)isoxazole-3-carboxamide Formula: C26H31N3O3S MolecularWeight: 465.60764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC3=CC=CS3)C(=O)CCC4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=NOC(=C2)CN(CC3=CC=CS3)C(=O)CCC4CCCC4

InChI

InChI=1S/C26H31N3O3S/c1-19-8-10-21(11-9-19)16-27-26(31)24-15-22(32-28-24)17-29(18-23-7-4-14-33-23)25(30)13-12-20-5-2-3-6-20/h4,7-11,14-15,20H,2-3,5-6,12-13,16-18H2,1H3,(H,27,31)