N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(4-bromanylphenoxy)ethanamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(4-bromanylphenoxy)ethanamide Openeye Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(4-bromophenoxy)acetamide CAS Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)acetamide IUPAC Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(4-bromophenoxy)acetamide Traditional Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(4-bromophenoxy)acetamide Formula: C22H17BrN2O3S MolecularWeight: 469.35098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3S/c1-27-19-11-6-14(22-25-17-4-2-3-5-20(17)29-22)12-18(19)24-21(26)13-28-16-9-7-15(23)8-10-16/h2-12H,13H2,1H3,(H,24,26)