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

Systemtic Name: 2-(4-bromanyl-8-chloranyl-naphthalen-1-yl)sulfanyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-bromo-8-chloro-1-naphthyl)sulfanyl]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-bromo-8-chloro-1-naphthalenyl)thio]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-bromo-8-chloronaphthalen-1-yl)sulfanyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-bromo-8-chloro-1-naphthyl)thio]-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H16BrClN2OS2 MolecularWeight: 491.85154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=C4C(=C(C=C3)Br)C=CC=C4Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CSC3=C4C(=C(C=C3)Br)C=CC=C4Cl)C

InChI

InChI=1S/C21H16BrClN2OS2/c1-11-8-12(2)20-17(9-11)28-21(25-20)24-18(26)10-27-16-7-6-14(22)13-4-3-5-15(23)19(13)16/h3-9H,10H2,1-2H3,(H,24,25,26)