N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromanyl-phenyl]-2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-2-(4-chloro-3,5-dimethyl-phenoxy)acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-2-(4-chloro-3,5-dimethylphenoxy)acetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromophenyl]-2-(4-chloro-3,5-dimethylphenoxy)acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-bromo-phenyl]-2-(4-chloro-3,5-dimethyl-phenoxy)acetamide Formula: C23H18BrClN2O2S MolecularWeight: 501.82322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC(=O)NC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4S3

InChI

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