N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[5-(3-chlorobenzyl)thiazol-2-yl]-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C16H18ClN4O2S+ MolecularWeight: 365.85772

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H17ClN4O2S/c17-12-3-1-2-11(6-12)7-13-8-19-16(24-13)20-15(23)10-21-5-4-18-14(22)9-21/h1-3,6,8H,4-5,7,9-10H2,(H,18,22)(H,19,20,23)/p+1