2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3-thiazol-2-yl)ethanamide Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-thiazol-2-yl-acetamide CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]-N-(2-thiazolyl)acetamide IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)-N-(1,3-thiazol-2-yl)acetamide Traditional Name: 2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]-N-thiazol-2-yl-acetamide Formula: C13H17N6OS+ MolecularWeight: 305.37868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=NC=CS2)C3=NC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=NC=CS2)C3=NC=CC=N3

InChI

InChI=1S/C13H16N6OS/c20-11(17-13-16-4-9-21-13)10-18-5-7-19(8-6-18)12-14-2-1-3-15-12/h1-4,9H,5-8,10H2,(H,16,17,20)/p+1