2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(4-bromanyl-2-fluoranyl-phenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(4-bromo-2-fluoro-phenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-(4-bromo-2-fluorophenyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(4-bromo-2-fluorophenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-(4-bromo-2-fluoro-phenyl)acetamide Formula: C16H12BrFN2OS2 MolecularWeight: 411.311683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CSCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C16H12BrFN2OS2/c17-10-5-6-12(11(18)7-10)19-15(21)8-22-9-16-20-13-3-1-2-4-14(13)23-16/h1-7H,8-9H2,(H,19,21)