2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-quinolin-5-yl-propanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-quinolin-5-yl-propanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(5-quinolyl)propanamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-(5-quinolyl)propionamide Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=CC=CC=[N+]3[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H15N3O2S/c1-12(23-16-9-2-3-11-20(16)22)17(21)19-15-8-4-7-14-13(15)6-5-10-18-14/h2-12H,1H3,(H,19,21)