2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-[(4,8-dimethyl-2-quinolinyl)thio]ethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(4,8-dimethylquinolin-2-yl)sulfanylethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[2-[(4,8-dimethyl-2-quinolyl)thio]ethyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C20H18N2O3S2/c1-13-6-5-8-15-14(2)12-18(21-19(13)15)26-11-10-22-20(23)16-7-3-4-9-17(16)27(22,24)25/h3-9,12H,10-11H2,1-2H3