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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloranyl-phenyl]-2-(2-bromanyl-4,6-dimethyl-phenoxy)ethanamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-2-(2-bromo-4,6-dimethylphenoxy)acetamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4-chloro-phenyl]-2-(2-bromo-4,6-dimethyl-phenoxy)acetamide Formula: C23H18BrClN2O2S MolecularWeight: 501.82322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H18BrClN2O2S/c1-13-9-14(2)22(17(24)10-13)29-12-21(28)26-15-7-8-18(25)16(11-15)23-27-19-5-3-4-6-20(19)30-23/h3-11H,12H2,1-2H3,(H,26,28)