2-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-bromanylpyrimidin-2-yl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-bromanylpyrimidin-2-yl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-bromopyrimidin-2-yl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(5-bromo-2-pyrimidinyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-bromopyrimidin-2-yl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(5-bromopyrimidin-2-yl)acetamide Formula: C13H9BrN4OS2 MolecularWeight: 381.27076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC=C(C=N3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCC(=O)NC3=NC=C(C=N3)Br

InChI

InChI=1S/C13H9BrN4OS2/c14-8-5-15-12(16-6-8)18-11(19)7-20-13-17-9-3-1-2-4-10(9)21-13/h1-6H,7H2,(H,15,16,18,19)