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

Systemtic Name: 2-(4-bromanyl-2-tert-butyl-phenoxy)-N-(6-ethoxy-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(6-ethoxy-1,3-benzothiazol-2-yl)acetamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=C(C=C(C=C3)Br)C(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=C(C=C(C=C3)Br)C(C)(C)C

InChI

InChI=1S/C21H23BrN2O3S/c1-5-26-14-7-8-16-18(11-14)28-20(23-16)24-19(25)12-27-17-9-6-13(22)10-15(17)21(2,3)4/h6-11H,5,12H2,1-4H3,(H,23,24,25)