2-(3-bromanyl-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C20H23BrN2OS MolecularWeight: 419.37842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C20H23BrN2OS/c1-12-3-2-4-15-17(12)23-18(25-15)22-16(24)10-19-6-13-5-14(7-19)9-20(21,8-13)11-19/h2-4,13-14H,5-11H2,1H3,(H,22,23,24)