N-(3-cyanothiophen-2-yl)-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-(4-ethanoylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyano-2-thienyl)acetamide CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-N-(3-cyano-2-thiophenyl)acetamide IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyanothiophen-2-yl)acetamide Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyano-2-thienyl)acetamide Formula: C13H17N4O2S+ MolecularWeight: 293.36468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C13H16N4O2S/c1-10(18)17-5-3-16(4-6-17)9-12(19)15-13-11(8-14)2-7-20-13/h2,7H,3-6,9H2,1H3,(H,15,19)/p+1