N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromanylphenoxy)ethanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromanylphenoxy)ethanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromophenoxy)acetamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromophenoxy)acetamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromophenoxy)acetamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-bromophenoxy)acetamide Formula: C17H14BrN3O3S MolecularWeight: 420.28036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)Br

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrN3O3S/c1-10(22)19-12-4-7-14-15(8-12)25-17(20-14)21-16(23)9-24-13-5-2-11(18)3-6-13/h2-8H,9H2,1H3,(H,19,22)(H,20,21,23)