N-(2-ethylphenyl)-2-[methyl(2-quinolin-2-ylsulfanylethanoyl)amino]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[methyl(2-quinolin-2-ylsulfanylethanoyl)amino]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[methyl-[2-(2-quinolylsulfanyl)acetyl]amino]acetamide CAS Name: N-(2-ethylphenyl)-2-[methyl-[1-oxo-2-(2-quinolinylthio)ethyl]amino]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[methyl-(2-quinolin-2-ylsulfanylacetyl)amino]acetamide Traditional Name: N-(2-ethylphenyl)-2-[methyl-[2-(2-quinolylthio)acetyl]amino]acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H23N3O2S/c1-3-16-8-4-6-10-18(16)23-20(26)14-25(2)22(27)15-28-21-13-12-17-9-5-7-11-19(17)24-21/h4-13H,3,14-15H2,1-2H3,(H,23,26)