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

Systemtic Name: 2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]-N-[2-(1,3-thiazol-4-yl)ethyl]ethanamide Openeye Name: 2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]-N-(2-thiazol-4-ylethyl)acetamide CAS Name: 2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]-N-[2-(4-thiazolyl)ethyl]acetamide IUPAC Name: 2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide Traditional Name: 2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]-N-(2-thiazol-4-ylethyl)acetamide Formula: C19H25N4O2S+ MolecularWeight: 373.4924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCC2=CSC=N2)CCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCC2=CSC=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O2S/c24-18(20-8-6-16-13-26-14-22-16)12-17-19(25)21-9-11-23(17)10-7-15-4-2-1-3-5-15/h1-5,13-14,17H,6-12H2,(H,20,24)(H,21,25)/p+1/t17-/m1/s1