2-[3-(4-ethanoylpiperazin-1-ium-1-yl)propanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[3-(4-ethanoylpiperazin-1-ium-1-yl)propanoylamino]thiophene-3-carboxamide Openeye Name: 2-[3-(4-acetylpiperazin-1-ium-1-yl)propanoylamino]thiophene-3-carboxamide CAS Name: 2-[[3-(4-acetyl-1-piperazin-1-iumyl)-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[3-(4-acetylpiperazin-1-ium-1-yl)propanoylamino]thiophene-3-carboxamide Traditional Name: 2-[3-(4-acetylpiperazin-1-ium-1-yl)propanoylamino]thiophene-3-carboxamide Formula: C14H21N4O3S+ MolecularWeight: 325.40654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O3S/c1-10(19)18-7-5-17(6-8-18)4-2-12(20)16-14-11(13(15)21)3-9-22-14/h3,9H,2,4-8H2,1H3,(H2,15,21)(H,16,20)/p+1