N-(1-cyanocyclopentyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C13H15N3O2S/c14-10-13(6-2-3-7-13)15-11(17)9-19-12-5-1-4-8-16(12)18/h1,4-5,8H,2-3,6-7,9H2,(H,15,17)