2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)ethanamide Openeye Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide IUPAC Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C21H23BrN2O2S MolecularWeight: 447.38852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C21H23BrN2O2S/c1-12(2)15-9-17(22)13(3)8-18(15)26-11-20(25)24-21-16(10-23)14-6-4-5-7-19(14)27-21/h8-9,12H,4-7,11H2,1-3H3,(H,24,25)