4-[(6,7-dimethoxy-3-methyl-quinolin-2-yl)-sulfanyl-methyl]-1H-quinolin-2-one

Systemtic Name: 4-[(6,7-dimethoxy-3-methyl-quinolin-2-yl)-sulfanyl-methyl]-1H-quinolin-2-one Openeye Name: 4-[(6,7-dimethoxy-3-methyl-2-quinolyl)-sulfanyl-methyl]-1H-quinolin-2-one CAS Name: 4-[(6,7-dimethoxy-3-methyl-2-quinolinyl)-mercaptomethyl]-1H-quinolin-2-one IUPAC Name: 4-[(6,7-dimethoxy-3-methylquinolin-2-yl)-sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[(6,7-dimethoxy-3-methyl-2-quinolyl)-mercapto-methyl]carbostyril Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=C(C(=CC2=C1)OC)OC)C(C3=CC(=O)NC4=CC=CC=C43)S

Isomeric SMILES

CC1=C(N=C2C=C(C(=CC2=C1)OC)OC)C(C3=CC(=O)NC4=CC=CC=C43)S

InChI

InChI=1S/C22H20N2O3S/c1-12-8-13-9-18(26-2)19(27-3)11-17(13)24-21(12)22(28)15-10-20(25)23-16-7-5-4-6-14(15)16/h4-11,22,28H,1-3H3,(H,23,25)