4-[(3,8-dimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one

Systemtic Name: 4-[(3,8-dimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[(3,8-dimethyl-2-quinolyl)sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[(3,8-dimethyl-2-quinolinyl)thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[(3,8-dimethylquinolin-2-yl)sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[(3,8-dimethyl-2-quinolyl)thio]methyl]carbostyril Formula: C21H18N2OS MolecularWeight: 346.44542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)SCC3=CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)SCC3=CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C21H18N2OS/c1-13-6-5-7-15-10-14(2)21(23-20(13)15)25-12-16-11-19(24)22-18-9-4-3-8-17(16)18/h3-11H,12H2,1-2H3,(H,22,24)