5-pyridin-4-yl-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide

Systemtic Name: 5-pyridin-4-yl-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide Openeye Name: 5-(4-pyridyl)-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide CAS Name: 5-pyridin-4-yl-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide IUPAC Name: 5-pyridin-4-yl-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide Traditional Name: 5-(4-pyridyl)-2-thia-5-azabicyclo[2.1.1]hex-3-en-6-one azide Formula: C9H6N5OS- MolecularWeight: 232.24184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1N2C3C(=O)C2=CS3.[N-]=[N+]=[N-]

Isomeric SMILES

C1=CN=CC=C1N2C3C(=O)C2=CS3.[N-]=[N+]=[N-]

InChI

InChI=1S/C9H6N2OS.N3/c12-8-7-5-13-9(8)11(7)6-1-3-10-4-2-6;1-3-2/h1-5,9H;/q;-1