2-(2,4-dimethylquinolin-3-yl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one hydrochloride

Systemtic Name: 2-(2,4-dimethylquinolin-3-yl)-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one hydrochloride Openeye Name: 2-(2,4-dimethyl-3-quinolyl)-1,1-dioxo-1,2-benzothiazol-3-one hydrochloride CAS Name: 2-(2,4-dimethyl-3-quinolinyl)-1,1-dioxo-1,2-benzothiazol-3-one hydrochloride IUPAC Name: 2-(2,4-dimethylquinolin-3-yl)-1,1-dioxo-1,2-benzothiazol-3-one hydrochloride Traditional Name: 2-(2,4-dimethyl-3-quinolyl)-1,1-diketo-1,2-benzothiazol-3-one hydrochloride Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)N3C(=O)C4=CC=CC=C4S3(=O)=O.Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)N3C(=O)C4=CC=CC=C4S3(=O)=O.Cl

InChI

InChI=1S/C18H14N2O3S.ClH/c1-11-13-7-3-5-9-15(13)19-12(2)17(11)20-18(21)14-8-4-6-10-16(14)24(20,22)23;/h3-10H,1-2H3;1H