N-(2,3-dimethylcyclohexyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanamide Openeye Name: N-(2,3-dimethylcyclohexyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanamide CAS Name: N-(2,3-dimethylcyclohexyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]propanamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanamide Traditional Name: N-(2,3-dimethylcyclohexyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]propionamide Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C(C)SC2=CC=CC=[N+]2[O-]

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C(C)SC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C16H24N2O2S/c1-11-7-6-8-14(12(11)2)17-16(19)13(3)21-15-9-4-5-10-18(15)20/h4-5,9-14H,6-8H2,1-3H3,(H,17,19)