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

Systemtic Name: 2-(4-bromanyl-2-tert-butyl-phenoxy)-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(4-bromo-2-tert-butylphenoxy)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-bromo-2-tert-butyl-phenoxy)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H21BrN2O2S MolecularWeight: 433.36194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)COC3=C(C=C(C=C3)Br)C(C)(C)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)COC3=C(C=C(C=C3)Br)C(C)(C)C

InChI

InChI=1S/C20H21BrN2O2S/c1-12-6-5-7-16-18(12)23-19(26-16)22-17(24)11-25-15-9-8-13(21)10-14(15)20(2,3)4/h5-10H,11H2,1-4H3,(H,22,23,24)