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

Systemtic Name: 2-(4-bromanyl-2-ethyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-bromo-2-ethyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(4-bromo-2-ethylphenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-bromo-2-ethylphenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-bromo-2-ethyl-phenoxy)-N-(6-butyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H23BrN2O2S MolecularWeight: 447.38852

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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)Br)CC

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN2O2S/c1-3-5-6-14-7-9-17-19(11-14)27-21(23-17)24-20(25)13-26-18-10-8-16(22)12-15(18)4-2/h7-12H,3-6,13H2,1-2H3,(H,23,24,25)