2-[(2-methyl-1,3-thiazol-4-yl)methylazaniumyl]ethanoate

Systemtic Name: 2-[(2-methyl-1,3-thiazol-4-yl)methylazaniumyl]ethanoate Openeye Name: 2-[(2-methylthiazol-4-yl)methylammonio]acetate CAS Name: 2-[(2-methyl-4-thiazolyl)methylammonio]acetate IUPAC Name: 2-[(2-methyl-1,3-thiazol-4-yl)methylazaniumyl]acetate Traditional Name: 2-[(2-methylthiazol-4-yl)methylammonio]acetate Formula: C7H10N2O2S MolecularWeight: 186.2315

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH2+]CC(=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)C[NH2+]CC(=O)[O-]

InChI

InChI=1S/C7H10N2O2S/c1-5-9-6(4-12-5)2-8-3-7(10)11/h4,8H,2-3H2,1H3,(H,10,11)