4-[(3,6,7-trimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one

Systemtic Name: 4-[(3,6,7-trimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[(3,6,7-trimethyl-2-quinolyl)sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[(3,6,7-trimethyl-2-quinolinyl)thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[(3,6,7-trimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[(3,6,7-trimethyl-2-quinolyl)thio]methyl]carbostyril Formula: C22H20N2OS MolecularWeight: 360.472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(C=C2N=C1SCC3=CC(=O)NC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC2=CC(=C(C=C2N=C1SCC3=CC(=O)NC4=CC=CC=C43)C)C

InChI

InChI=1S/C22H20N2OS/c1-13-8-16-9-15(3)22(24-20(16)10-14(13)2)26-12-17-11-21(25)23-19-7-5-4-6-18(17)19/h4-11H,12H2,1-3H3,(H,23,25)