N-cyclopropyl-3-[1-[(2S)-4-methyl-4-methylsulfanyl-pentan-2-yl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[1-[(2S)-4-methyl-4-methylsulfanyl-pentan-2-yl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-cyclopropyl-3-[1-[(1S)-1,3-dimethyl-3-methylsulfanyl-butyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-cyclopropyl-3-[1-[(2S)-4-methyl-4-(methylthio)pentan-2-yl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[1-[(2S)-4-methyl-4-methylsulfanylpentan-2-yl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-cyclopropyl-3-[1-[(1S)-1,3-dimethyl-3-(methylthio)butyl]piperidin-1-ium-4-yl]propionamide Formula: C18H35N2OS+ MolecularWeight: 327.5483

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C)SC)[NH+]1CCC(CC1)CCC(=O)NC2CC2

Isomeric SMILES

C[C@@H](CC(C)(C)SC)[NH+]1CCC(CC1)CCC(=O)NC2CC2

InChI

InChI=1S/C18H34N2OS/c1-14(13-18(2,3)22-4)20-11-9-15(10-12-20)5-8-17(21)19-16-6-7-16/h14-16H,5-13H2,1-4H3,(H,19,21)/p+1/t14-/m0/s1