1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-cyclopentyl-imidazolidine-2,4,5-trione

Systemtic Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-cyclopentyl-imidazolidine-2,4,5-trione Openeye Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-cyclopentyl-imidazolidine-2,4,5-trione CAS Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)-1-piperidin-1-iumyl]methyl]-3-cyclopentylimidazolidine-2,4,5-trione IUPAC Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-cyclopentylimidazolidine-2,4,5-trione Traditional Name: 1-[[(2R)-2-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]methyl]-3-cyclopentyl-imidazolidine-2,4,5-trione Formula: C21H25N4O3S+ MolecularWeight: 413.5132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C(=O)N(C2=O)C[NH+]3CCCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C2=NC3=CC=CC=C3S2)CN4C(=O)C(=O)N(C4=O)C5CCCC5

InChI

InChI=1S/C21H24N4O3S/c26-19-20(27)25(14-7-1-2-8-14)21(28)24(19)13-23-12-6-5-10-16(23)18-22-15-9-3-4-11-17(15)29-18/h3-4,9,11,14,16H,1-2,5-8,10,12-13H2/p+1/t16-/m1/s1