(2S)-2-piperazin-1-ium-1-yl-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: (2S)-2-piperazin-1-ium-1-yl-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: (2S)-2-piperazin-1-ium-1-yl-N-[2-(2-thienyl)ethyl]propanamide CAS Name: (2S)-2-(1-piperazin-1-iumyl)-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: (2S)-2-piperazin-1-ium-1-yl-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: (2S)-2-piperazin-1-ium-1-yl-N-[2-(2-thienyl)ethyl]propionamide Formula: C13H22N3OS+ MolecularWeight: 268.39828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CS1)[NH+]2CCNCC2

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=CS1)[NH+]2CCNCC2

InChI

InChI=1S/C13H21N3OS/c1-11(16-8-6-14-7-9-16)13(17)15-5-4-12-3-2-10-18-12/h2-3,10-11,14H,4-9H2,1H3,(H,15,17)/p+1/t11-/m0/s1