2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-carbonitrile

Systemtic Name: 2-[(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-carbonitrile Openeye Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-carbonitrile CAS Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylthio]-3-pyridinecarbonitrile IUPAC Name: 2-[(4-oxo-1,2,3-benzotriazin-3-yl)methylsulfanyl]pyridine-3-carbonitrile Traditional Name: 2-[(4-keto-1,2,3-benzotriazin-3-yl)methylthio]nicotinonitrile Formula: C14H9N5OS MolecularWeight: 295.31916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=CC=N3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)CSC3=C(C=CC=N3)C#N

InChI

InChI=1S/C14H9N5OS/c15-8-10-4-3-7-16-13(10)21-9-19-14(20)11-5-1-2-6-12(11)17-18-19/h1-7H,9H2