2-(2-azaniumylethyl)-1,3-thiazole-4-carboxylate

Systemtic Name: 2-(2-azaniumylethyl)-1,3-thiazole-4-carboxylate Openeye Name: 2-(2-azaniumylethyl)thiazole-4-carboxylate CAS Name: 2-(2-ammonioethyl)-4-thiazolecarboxylate IUPAC Name: 2-(2-azaniumylethyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(2-ammonioethyl)thiazole-4-carboxylate Formula: C6H8N2O2S MolecularWeight: 172.20492

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(S1)CC[NH3+])C(=O)[O-]

Isomeric SMILES

C1=C(N=C(S1)CC[NH3+])C(=O)[O-]

InChI

InChI=1S/C6H8N2O2S/c7-2-1-5-8-4(3-11-5)6(9)10/h3H,1-2,7H2,(H,9,10)