3-bromanyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-bromanyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-bromo-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-bromo-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-bromo-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-bromo-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)propionamide Formula: C12H13BrN2OS MolecularWeight: 313.21342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)CCBr

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)NC(=O)CCBr

InChI

InChI=1S/C12H13BrN2OS/c1-7-5-9-10(6-8(7)2)17-12(14-9)15-11(16)3-4-13/h5-6H,3-4H2,1-2H3,(H,14,15,16)