2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: N-mesityl-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=CC=CC=[N+]2[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C(C)SC2=CC=CC=[N+]2[O-])C

InChI

InChI=1S/C17H20N2O2S/c1-11-9-12(2)16(13(3)10-11)18-17(20)14(4)22-15-7-5-6-8-19(15)21/h5-10,14H,1-4H3,(H,18,20)