N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-thiophen-3-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-(thiophene-3-carbonyl)piperidine-4-carboxamide CAS Name: 1-[oxo(3-thiophenyl)methyl]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-(thiophene-3-carbonyl)piperidine-4-carboxamide Traditional Name: N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-1-(3-thenoyl)isonipecotamide Formula: C23H36N3O2S+ MolecularWeight: 418.61584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C(=O)C3=CSC=C3)[NH+]4CCCCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2CCN(CC2)C(=O)C3=CSC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C23H35N3O2S/c27-21(19-7-14-25(15-8-19)22(28)20-9-16-29-17-20)24-18-23(10-3-1-4-11-23)26-12-5-2-6-13-26/h9,16-17,19H,1-8,10-15,18H2,(H,24,27)/p+1