2-[(2R)-3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: N-(3-isopropoxypropyl)-2-[(2R)-3-oxo-1-(2-thienylmethyl)piperazin-1-ium-2-yl]acetamide CAS Name: 2-[(2R)-3-oxo-1-(thiophen-2-ylmethyl)-2-piperazin-1-iumyl]-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-[(2R)-3-oxo-1-(thiophen-2-ylmethyl)piperazin-1-ium-2-yl]-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: N-(3-isopropoxypropyl)-2-[(2R)-3-keto-1-(2-thenyl)piperazin-1-ium-2-yl]acetamide Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CC1C(=O)NCC[NH+]1CC2=CC=CS2

Isomeric SMILES

CC(C)OCCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CS2

InChI

InChI=1S/C17H27N3O3S/c1-13(2)23-9-4-6-18-16(21)11-15-17(22)19-7-8-20(15)12-14-5-3-10-24-14/h3,5,10,13,15H,4,6-9,11-12H2,1-2H3,(H,18,21)(H,19,22)/p+1/t15-/m1/s1