2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]ethanamide

Systemtic Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-2-methyl-1-thiophen-2-yl-propyl]ethanamide Openeye Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-2-methyl-1-(2-thienyl)propyl]acetamide CAS Name: 2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]acetamide IUPAC Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]acetamide Traditional Name: 2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[(1S)-2-methyl-1-(2-thienyl)propyl]acetamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)[C@@H](C1=CC=CS1)NC(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H27N3O2S/c1-15(2)20(18-4-3-13-26-18)21-19(25)14-22-9-11-23(12-10-22)16-5-7-17(24)8-6-16/h3-8,13,15,20,24H,9-12,14H2,1-2H3,(H,21,25)/p+1/t20-/m0/s1