N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-2-methylsulfanyl-benzamide

Systemtic Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-2-methylsulfanyl-benzamide Openeye Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-2-methylsulfanyl-benzamide CAS Name: N-[3-[(2S)-2-ethyl-1-piperidin-1-iumyl]propyl]-2-(methylthio)benzamide IUPAC Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-2-methylsulfanylbenzamide Traditional Name: N-[3-[(2S)-2-ethylpiperidin-1-ium-1-yl]propyl]-2-(methylthio)benzamide Formula: C18H29N2OS+ MolecularWeight: 321.50066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CCCNC(=O)C2=CC=CC=C2SC

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC=CC=C2SC

InChI

InChI=1S/C18H28N2OS/c1-3-15-9-6-7-13-20(15)14-8-12-19-18(21)16-10-4-5-11-17(16)22-2/h4-5,10-11,15H,3,6-9,12-14H2,1-2H3,(H,19,21)/p+1/t15-/m0/s1