N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(4,8-dimethyl-2-oxidanylidene-quinolin-1-yl)butanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4,8-dimethyl-2-oxo-1-quinolyl)butanamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4,8-dimethyl-2-oxo-1-quinolinyl)butanamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4,8-dimethyl-2-oxoquinolin-1-yl)butanamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(2-keto-4,8-dimethyl-1-quinolyl)butyramide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)Cl)N3C(=O)C=C(C4=C3C(=CC=C4)C)C

InChI

InChI=1S/C22H20ClN3O2S/c1-4-17(21(28)25-22-24-16-9-8-14(23)11-18(16)29-22)26-19(27)10-13(3)15-7-5-6-12(2)20(15)26/h5-11,17H,4H2,1-3H3,(H,24,25,28)