3-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate

Systemtic Name: 3-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate Openeye Name: 3-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propanoate CAS Name: 3-[4-(2-thiazolyl)-1-piperazin-1-iumyl]propanoate IUPAC Name: 3-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate Traditional Name: 3-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propionate Formula: C10H15N3O2S MolecularWeight: 241.31

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)[O-])C2=NC=CS2

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)[O-])C2=NC=CS2

InChI

InChI=1S/C10H15N3O2S/c14-9(15)1-3-12-4-6-13(7-5-12)10-11-2-8-16-10/h2,8H,1,3-7H2,(H,14,15)