N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide Formula: C23H19BrN2O2S MolecularWeight: 467.37816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H19BrN2O2S/c1-14-11-15(2)22(17(24)12-14)28-13-21(27)25-18-8-4-3-7-16(18)23-26-19-9-5-6-10-20(19)29-23/h3-12H,13H2,1-2H3,(H,25,27)