5-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)-2-nitro-benzenecarbonitrile

Systemtic Name: 5-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)-2-nitro-benzenecarbonitrile Openeye Name: 5-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)-2-nitro-benzonitrile CAS Name: 5-(1H-imidazo[4,5-b]pyridin-2-ylthio)-2-nitrobenzonitrile IUPAC Name: 5-(1H-imidazo[4,5-b]pyridin-2-ylsulfanyl)-2-nitrobenzonitrile Traditional Name: 5-(1H-imidazo[4,5-b]pyridin-2-ylthio)-2-nitro-benzonitrile Formula: C13H7N5O2S MolecularWeight: 297.29198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N=C1)N=C(N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC2=C(N=C1)N=C(N2)SC3=CC(=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H7N5O2S/c14-7-8-6-9(3-4-11(8)18(19)20)21-13-16-10-2-1-5-15-12(10)17-13/h1-6H,(H,15,16,17)