(5S)-5-(3-phenylpropyl)-5-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione

Systemtic Name: (5S)-5-(3-phenylpropyl)-5-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Openeye Name: (5S)-5-(3-phenylpropyl)-5-[1-(2-thienylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione CAS Name: (5S)-5-(3-phenylpropyl)-5-[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]imidazolidine-2,4-dione IUPAC Name: (5S)-5-(3-phenylpropyl)-5-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]imidazolidine-2,4-dione Traditional Name: (5S)-5-(3-phenylpropyl)-5-[1-(2-thenyl)piperidin-1-ium-4-yl]hydantoin Formula: C22H28N3O2S+ MolecularWeight: 398.54162

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2(C(=O)NC(=O)N2)CCCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1[C@]2(C(=O)NC(=O)N2)CCCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C22H27N3O2S/c26-20-22(24-21(27)23-20,12-4-8-17-6-2-1-3-7-17)18-10-13-25(14-11-18)16-19-9-5-15-28-19/h1-3,5-7,9,15,18H,4,8,10-14,16H2,(H2,23,24,26,27)/p+1/t22-/m0/s1