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

Systemtic Name: N-(cyclopentylcarbamoyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(cyclopentylcarbamoyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(cyclopentylcarbamoyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(cyclopentylcarbamoyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S/c17-11(9-20-12-7-3-4-8-16(12)19)15-13(18)14-10-5-1-2-6-10/h3-4,7-8,10H,1-2,5-6,9H2,(H2,14,15,17,18)