N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[2-(2-oxidanylidenepyrrolidin-1-yl)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[2-(2-oxopyrrolidin-1-yl)thiazol-4-yl]acetamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-[2-(2-oxo-1-pyrrolidinyl)-4-thiazolyl]acetamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide Traditional Name: 2-[2-(2-ketopyrrolidino)thiazol-4-yl]-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C20H26N5O2S+ MolecularWeight: 400.51774

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CC3=CSC(=N3)N4CCCC4=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)CC3=CSC(=N3)N4CCCC4=O

InChI

InChI=1S/C20H25N5O2S/c1-23-9-11-24(12-10-23)17-6-3-2-5-16(17)22-18(26)13-15-14-28-20(21-15)25-8-4-7-19(25)27/h2-3,5-6,14H,4,7-13H2,1H3,(H,22,26)/p+1