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

Systemtic Name: 3-bromanyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-bromo-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-bromo-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-bromo-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-bromo-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C10H8BrN3O3S MolecularWeight: 330.15782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCBr

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCBr

InChI

InChI=1S/C10H8BrN3O3S/c11-4-3-9(15)13-10-12-7-2-1-6(14(16)17)5-8(7)18-10/h1-2,5H,3-4H2,(H,12,13,15)