N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-(thiophen-3-ylmethylsulfanyl)benzamide

Systemtic Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-(thiophen-3-ylmethylsulfanyl)benzamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-2-(3-thienylmethylsulfanyl)benzamide CAS Name: N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-(3-thiophenylmethylthio)benzamide IUPAC Name: N-(1-propan-2-ylpiperidin-1-ium-4-yl)-2-(thiophen-3-ylmethylsulfanyl)benzamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-2-(3-thenylthio)benzamide Formula: C20H27N2OS2+ MolecularWeight: 375.57118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=CC=C2SCC3=CSC=C3

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)C2=CC=CC=C2SCC3=CSC=C3

InChI

InChI=1S/C20H26N2OS2/c1-15(2)22-10-7-17(8-11-22)21-20(23)18-5-3-4-6-19(18)25-14-16-9-12-24-13-16/h3-6,9,12-13,15,17H,7-8,10-11,14H2,1-2H3,(H,21,23)/p+1