N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C21H31N4O2S+ MolecularWeight: 403.56144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CCC2=NC(=NO2)C3=CSC=C3)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CCC2=NC(=NO2)C3=CSC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C21H30N4O2S/c26-18(7-8-19-23-20(24-27-19)17-9-14-28-15-17)22-16-21(10-3-1-4-11-21)25-12-5-2-6-13-25/h9,14-15H,1-8,10-13,16H2,(H,22,26)/p+1