2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]ethanamide

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]ethanamide Openeye Name: 2-[(2R)-1-isopropyl-3-oxo-piperazin-1-ium-2-yl]-N-[2-(4-phenylthiazol-2-yl)ethyl]acetamide CAS Name: 2-[(2R)-3-oxo-1-propan-2-yl-2-piperazin-1-iumyl]-N-[2-(4-phenyl-2-thiazolyl)ethyl]acetamide IUPAC Name: 2-[(2R)-3-oxo-1-propan-2-ylpiperazin-1-ium-2-yl]-N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide Traditional Name: 2-[(2R)-1-isopropyl-3-keto-piperazin-1-ium-2-yl]-N-[2-(4-phenylthiazol-2-yl)ethyl]acetamide Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCNC(=O)C1CC(=O)NCCC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCNC(=O)[C@H]1CC(=O)NCCC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2S/c1-14(2)24-11-10-22-20(26)17(24)12-18(25)21-9-8-19-23-16(13-27-19)15-6-4-3-5-7-15/h3-7,13-14,17H,8-12H2,1-2H3,(H,21,25)(H,22,26)/p+1/t17-/m1/s1