(2S)-N-ethyl-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2S)-N-ethyl-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2S)-N-ethyl-2-[4-(2-thienylmethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: (2S)-N-ethyl-2-[4-(thiophen-2-ylmethyl)-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2S)-N-ethyl-2-[4-(thiophen-2-ylmethyl)piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2S)-N-ethyl-2-[4-(2-thenyl)piperazine-1,4-diium-1-yl]propionamide Formula: C14H25N3OS+2 MolecularWeight: 283.4328

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)[NH+]1CC[NH+](CC1)CC2=CC=CS2

Isomeric SMILES

CCNC(=O)[C@H](C)[NH+]1CC[NH+](CC1)CC2=CC=CS2

InChI

InChI=1S/C14H23N3OS/c1-3-15-14(18)12(2)17-8-6-16(7-9-17)11-13-5-4-10-19-13/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,15,18)/p+2/t12-/m0/s1