N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-2-(2-pyrimidylthio)acetamide Formula: C13H9BrN4OS2 MolecularWeight: 381.27076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

Isomeric SMILES

C1=CN=C(N=C1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)Br

InChI

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