4-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-2-[(4,6,8-trimethyl-2-quinolinyl)thio]ethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[(4,6,8-trimethyl-2-quinolyl)thio]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)N3CC(=O)NC4=CC=CC=C43)C)C

InChI

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