2-piperidin-1-ium-1-yl-N-[2-(2H-1,2,3-triazol-4-ylsulfanyl)ethyl]-1,3-dihydroindene-2-carboxamide

Systemtic Name: 2-piperidin-1-ium-1-yl-N-[2-(2H-1,2,3-triazol-4-ylsulfanyl)ethyl]-1,3-dihydroindene-2-carboxamide Openeye Name: 2-piperidin-1-ium-1-yl-N-[2-(2H-triazol-4-ylsulfanyl)ethyl]indane-2-carboxamide CAS Name: 2-(1-piperidin-1-iumyl)-N-[2-(2H-triazol-4-ylthio)ethyl]-1,3-dihydroindene-2-carboxamide IUPAC Name: 2-piperidin-1-ium-1-yl-N-[2-(2H-triazol-4-ylsulfanyl)ethyl]-1,3-dihydroindene-2-carboxamide Traditional Name: 2-piperidin-1-ium-1-yl-N-[2-(2H-triazol-4-ylthio)ethyl]indane-2-carboxamide Formula: C19H26N5OS+ MolecularWeight: 372.50764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCCSC4=NNN=C4

Isomeric SMILES

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)NCCSC4=NNN=C4

InChI

InChI=1S/C19H25N5OS/c25-18(20-8-11-26-17-14-21-23-22-17)19(24-9-4-1-5-10-24)12-15-6-2-3-7-16(15)13-19/h2-3,6-7,14H,1,4-5,8-13H2,(H,20,25)(H,21,22,23)/p+1