2-phenyl-N-[2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]ethanamide

Systemtic Name: 2-phenyl-N-[2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]ethanamide Openeye Name: 2-phenyl-N-[2-[4-(2-thienylmethyl)piperazin-4-ium-1-carbonyl]phenyl]acetamide CAS Name: N-[2-[oxo-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methyl]phenyl]-2-phenylacetamide IUPAC Name: 2-phenyl-N-[2-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carbonyl]phenyl]acetamide Traditional Name: 2-phenyl-N-[2-[4-(2-thenyl)piperazin-4-ium-1-carbonyl]phenyl]acetamide Formula: C24H26N3O2S+ MolecularWeight: 420.54714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=CC=C3NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CC=CC=C3NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O2S/c28-23(17-19-7-2-1-3-8-19)25-22-11-5-4-10-21(22)24(29)27-14-12-26(13-15-27)18-20-9-6-16-30-20/h1-11,16H,12-15,17-18H2,(H,25,28)/p+1