N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-bis(bromanyl)phenyl]ethanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-bis(bromanyl)phenyl]ethanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-dibromo-phenyl]acetamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-dibromophenyl]acetamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-dibromophenyl]acetamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethoxy)-3,5-dibromo-phenyl]acetamide Formula: C16H12Br2N2O2S MolecularWeight: 456.15168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C(=C1)Br)OCC2=NC3=CC=CC=C3S2)Br

Isomeric SMILES

CC(=O)NC1=CC(=C(C(=C1)Br)OCC2=NC3=CC=CC=C3S2)Br

InChI

InChI=1S/C16H12Br2N2O2S/c1-9(21)19-10-6-11(17)16(12(18)7-10)22-8-15-20-13-4-2-3-5-14(13)23-15/h2-7H,8H2,1H3,(H,19,21)