2-(4-methoxyphenyl)-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-yl-propan-2-yl]ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-[(1R,2S)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]acetamide CAS Name: 2-(4-methoxyphenyl)-N-[(1S,2R)-1-(4-phenyl-1-piperazin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-[(1S,2R)-1-(4-phenylpiperazin-1-ium-1-yl)-1-thiophen-2-ylpropan-2-yl]acetamide Traditional Name: 2-(4-methoxyphenyl)-N-[(1R,2S)-1-methyl-2-(4-phenylpiperazin-1-ium-1-yl)-2-(2-thienyl)ethyl]acetamide Formula: C26H32N3O2S+ MolecularWeight: 450.61618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)CC4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H]([C@@H](C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3)NC(=O)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N3O2S/c1-20(27-25(30)19-21-10-12-23(31-2)13-11-21)26(24-9-6-18-32-24)29-16-14-28(15-17-29)22-7-4-3-5-8-22/h3-13,18,20,26H,14-17,19H2,1-2H3,(H,27,30)/p+1/t20-,26+/m1/s1