N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromanylphenoxy)pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromanylphenoxy)pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromophenoxy)pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromophenoxy)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromophenoxy)pyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-6-(4-bromophenoxy)nicotinamide Formula: C20H14BrN3O2S MolecularWeight: 440.31306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CN=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNC(=O)C3=CN=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrN3O2S/c21-14-6-8-15(9-7-14)26-18-10-5-13(11-22-18)20(25)23-12-19-24-16-3-1-2-4-17(16)27-19/h1-11H,12H2,(H,23,25)