3-ethyl-5-(prop-2-enylamino)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 3-ethyl-5-(prop-2-enylamino)-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(allylamino)-3-ethyl-isothiazole-4-carboxylic acid CAS Name: 3-ethyl-5-(prop-2-enylamino)-4-isothiazolecarboxylic acid IUPAC Name: 3-ethyl-5-(prop-2-enylamino)-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(allylamino)-3-ethyl-isothiazole-4-carboxylic acid Formula: C9H12N2O2S MolecularWeight: 212.26878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NSC(=C1C(=O)O)NCC=C

Isomeric SMILES

CCC1=NSC(=C1C(=O)O)NCC=C

InChI

InChI=1S/C9H12N2O2S/c1-3-5-10-8-7(9(12)13)6(4-2)11-14-8/h3,10H,1,4-5H2,2H3,(H,12,13)