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

Systemtic Name: N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[3-(2-oxo-1-pyrrolidinyl)phenyl]-2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C19H24N5O2S+ MolecularWeight: 386.49116

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CS4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C[NH+]3CCN(CC3)C4=NC=CS4

InChI

InChI=1S/C19H23N5O2S/c25-17(14-22-8-10-23(11-9-22)19-20-6-12-27-19)21-15-3-1-4-16(13-15)24-7-2-5-18(24)26/h1,3-4,6,12-13H,2,5,7-11,14H2,(H,21,25)/p+1