N-(1,3-benzothiazol-2-yl)-2-[2,4-bis(bromanyl)phenoxy]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[2,4-bis(bromanyl)phenoxy]propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(2,4-dibromophenoxy)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(2,4-dibromophenoxy)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(2,4-dibromophenoxy)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(2,4-dibromophenoxy)propionamide Formula: C16H12Br2N2O2S MolecularWeight: 456.15168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC2=CC=CC=C2S1)OC3=C(C=C(C=C3)Br)Br

Isomeric SMILES

CC(C(=O)NC1=NC2=CC=CC=C2S1)OC3=C(C=C(C=C3)Br)Br

InChI

InChI=1S/C16H12Br2N2O2S/c1-9(22-13-7-6-10(17)8-11(13)18)15(21)20-16-19-12-4-2-3-5-14(12)23-16/h2-9H,1H3,(H,19,20,21)