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

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-thiazol-2-yl-acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazin-1-iumyl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-thiazol-2-yl-acetamide Formula: C16H21N4OS+ MolecularWeight: 317.42914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=NC=CS2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=NC=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N4OS/c21-15(18-16-17-6-11-22-16)13-20-9-7-19(8-10-20)12-14-4-2-1-3-5-14/h1-6,11H,7-10,12-13H2,(H,17,18,21)/p+1