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

Systemtic Name: (2R)-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-(thiophen-2-ylmethyl)propanamide Openeye Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(2-thienylmethyl)propanamide CAS Name: (2R)-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: (2R)-2-(4-benzylpiperazine-1,4-diium-1-yl)-N-(2-thenyl)propionamide Formula: C19H27N3OS+2 MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CS1)[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3OS/c1-16(19(23)20-14-18-8-5-13-24-18)22-11-9-21(10-12-22)15-17-6-3-2-4-7-17/h2-8,13,16H,9-12,14-15H2,1H3,(H,20,23)/p+2/t16-/m1/s1