4-[2-(3-ethyl-8-methyl-quinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-(3-ethyl-8-methyl-quinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(3-ethyl-8-methyl-2-quinolyl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[(3-ethyl-8-methyl-2-quinolinyl)thio]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-(3-ethyl-8-methylquinolin-2-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(3-ethyl-8-methyl-2-quinolyl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C22H21N3O2S MolecularWeight: 391.48604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C(=CC=CC2=C1)C)SCC(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CCC1=C(N=C2C(=CC=CC2=C1)C)SCC(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O2S/c1-3-15-11-16-8-6-7-14(2)21(16)24-22(15)28-13-20(27)25-12-19(26)23-17-9-4-5-10-18(17)25/h4-11H,3,12-13H2,1-2H3,(H,23,26)