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

Systemtic Name: N-(3-cyanothiophen-2-yl)-3-(4-ethanoylpiperazin-1-ium-1-yl)propanamide Openeye Name: 3-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyano-2-thienyl)propanamide CAS Name: 3-(4-acetyl-1-piperazin-1-iumyl)-N-(3-cyano-2-thiophenyl)propanamide IUPAC Name: 3-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyanothiophen-2-yl)propanamide Traditional Name: 3-(4-acetylpiperazin-1-ium-1-yl)-N-(3-cyano-2-thienyl)propionamide Formula: C14H19N4O2S+ MolecularWeight: 307.39126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N4O2S/c1-11(19)18-7-5-17(6-8-18)4-2-13(20)16-14-12(10-15)3-9-21-14/h3,9H,2,4-8H2,1H3,(H,16,20)/p+1