2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(6-bromanyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(6-bromanyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-(6-bromo-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-(6-bromo-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-(6-bromo-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-(6-bromo-1,3-benzothiazol-2-yl)acetamide Formula: C16H9BrN6OS2 MolecularWeight: 445.31626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C1=CC2=C(C=C1Br)SC(=N2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C16H9BrN6OS2/c17-10-1-2-11-12(4-10)26-16(21-11)22-13(24)7-25-15-9(6-19)3-8(5-18)14(20)23-15/h1-4H,7H2,(H2,20,23)(H,21,22,24)