2-(2-bromanyl-4-propyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-propyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2-bromo-4-propyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(2-bromo-4-propylphenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2-bromo-4-propylphenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2-bromo-4-propyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide Formula: C22H25BrN2O2S MolecularWeight: 461.4151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=C(C=C(C=C3)CCC)Br

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=C(C=C(C=C3)CCC)Br

InChI

InChI=1S/C22H25BrN2O2S/c1-3-5-7-16-8-10-18-20(13-16)28-22(24-18)25-21(26)14-27-19-11-9-15(6-4-2)12-17(19)23/h8-13H,3-7,14H2,1-2H3,(H,24,25,26)