3-nitro-N-oxidanyl-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide

Systemtic Name: 3-nitro-N-oxidanyl-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide Openeye Name: N-hydroxy-3-nitro-N'-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]benzamidine CAS Name: N-hydroxy-3-nitro-N'-[5-(3-pyridinyl)-1,3,4-thiadiazol-2-yl]benzenecarboximidamide IUPAC Name: N-hydroxy-3-nitro-N'-(5-pyridin-3-yl-1,3,4-thiadiazol-2-yl)benzenecarboximidamide Traditional Name: N-hydroxy-3-nitro-N'-[5-(3-pyridyl)-1,3,4-thiadiazol-2-yl]benzamidine Formula: C14H10N6O3S MolecularWeight: 342.3326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=NC2=NN=C(S2)C3=CN=CC=C3)NO

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C(=N/C2=NN=C(S2)C3=CN=CC=C3)/NO

InChI

InChI=1S/C14H10N6O3S/c21-19-12(9-3-1-5-11(7-9)20(22)23)16-14-18-17-13(24-14)10-4-2-6-15-8-10/h1-8,21H,(H,16,18,19)