N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-N-ethyl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-N-ethyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-N-ethyl-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-N-ethyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-N-ethyl-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C13H19ClN3O2S+ MolecularWeight: 316.82686

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)C[NH+]2CCNC(=O)C2

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)C[NH+]2CCNC(=O)C2

InChI

InChI=1S/C13H18ClN3O2S/c1-2-17(7-10-3-4-11(14)20-10)13(19)9-16-6-5-15-12(18)8-16/h3-4H,2,5-9H2,1H3,(H,15,18)/p+1