N-(1-cyanocyclohexyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C18H25N4O2S+ MolecularWeight: 361.4817

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H24N4O2S/c19-14-18(6-2-1-3-7-18)20-16(23)13-21-8-10-22(11-9-21)17(24)15-5-4-12-25-15/h4-5,12H,1-3,6-11,13H2,(H,20,23)/p+1