N-cyclopropyl-2-[4-[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[2-oxo-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[2-keto-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl]piperazin-1-ium-1-yl]acetamide Formula: C17H27N4O2S+ MolecularWeight: 351.48688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)CN2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

C[C@@H](C1=CC=CS1)NC(=O)CN2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C17H26N4O2S/c1-13(15-3-2-10-24-15)18-16(22)11-20-6-8-21(9-7-20)12-17(23)19-14-4-5-14/h2-3,10,13-14H,4-9,11-12H2,1H3,(H,18,22)(H,19,23)/p+1/t13-/m0/s1