(2R)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: (2R)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-(2-thienyl)ethyl]propanamide CAS Name: (2R)-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[2-(2-thienyl)ethyl]propionamide Formula: C20H29N3OS+2 MolecularWeight: 359.52876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CS1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NCCC1=CC=CS1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H27N3OS/c1-17(20(24)21-10-9-19-8-5-15-25-19)23-13-11-22(12-14-23)16-18-6-3-2-4-7-18/h2-8,15,17H,9-14,16H2,1H3,(H,21,24)/p+2/t17-/m1/s1