2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-ium-1-yl]-N-[(R)-phenyl(thiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-ium-1-yl]-N-[(R)-phenyl(thiophen-2-yl)methyl]ethanamide Openeye Name: 2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-ium-1-yl]-N-[(R)-phenyl(2-thienyl)methyl]acetamide CAS Name: 2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-1-iumyl]-N-[(R)-phenyl(thiophen-2-yl)methyl]acetamide IUPAC Name: 2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-ium-1-yl]-N-[(R)-phenyl(thiophen-2-yl)methyl]acetamide Traditional Name: 2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-1-ium-1-yl]-N-[(R)-phenyl(2-thienyl)methyl]acetamide Formula: C23H31N4O2S+ MolecularWeight: 427.58284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CC[NH+](CC2)CC(=O)NC(C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(=O)CN2CC[NH+](CC2)CC(=O)N[C@H](C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H30N4O2S/c28-21(24-23(20-9-6-16-30-20)19-7-2-1-3-8-19)17-25-12-14-26(15-13-25)18-22(29)27-10-4-5-11-27/h1-3,6-9,16,23H,4-5,10-15,17-18H2,(H,24,28)/p+1/t23-/m1/s1