N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C20H16ClN3OS2 MolecularWeight: 413.94354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C20H16ClN3OS2/c1-11-4-3-5-14-12(2)8-18(24-19(11)14)26-10-17(25)23-20-22-15-7-6-13(21)9-16(15)27-20/h3-9H,10H2,1-2H3,(H,22,23,25)