N-[(1R)-1-phenylethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-phenylethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-phenylethyl]-2-[4-(2-thienylmethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-phenylethyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-phenylethyl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-phenylethyl]-2-[4-(2-thenyl)piperazin-1-ium-1-yl]acetamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CS3

InChI

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