N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[(2-methylsulfanylphenoxy)methyl]isoxazole-3-carboxamide CAS Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[[2-(methylthio)phenoxy]methyl]-3-isoxazolecarboxamide IUPAC Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[(2-methylsulfanylphenoxy)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-5-[[2-(methylthio)phenoxy]methyl]isoxazole-3-carboxamide Formula: C23H25N3O3S MolecularWeight: 423.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)NCCN3CCCC4=CC=CC=C43

Isomeric SMILES

CSC1=CC=CC=C1OCC2=CC(=NO2)C(=O)NCCN3CCCC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O3S/c1-30-22-11-5-4-10-21(22)28-16-18-15-19(25-29-18)23(27)24-12-14-26-13-6-8-17-7-2-3-9-20(17)26/h2-5,7,9-11,15H,6,8,12-14,16H2,1H3,(H,24,27)