N-(2-piperidin-1-ium-1-ylethyl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-piperidin-1-ium-1-ylethyl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-piperidin-1-ium-1-ylethyl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-[2-(1-piperidin-1-iumyl)ethyl]-2-(2-quinolinylthio)acetamide IUPAC Name: N-(2-piperidin-1-ium-1-ylethyl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(2-piperidin-1-ium-1-ylethyl)-2-(2-quinolylthio)acetamide Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H23N3OS/c22-17(19-10-13-21-11-4-1-5-12-21)14-23-18-9-8-15-6-2-3-7-16(15)20-18/h2-3,6-9H,1,4-5,10-14H2,(H,19,22)/p+1