4-[2-azanyl-1-(furan-2-yl)-2-sulfanylidene-ethyl]-3-methyl-1,2-thiazole-5-carboxylic acid

Systemtic Name: 4-[2-azanyl-1-(furan-2-yl)-2-sulfanylidene-ethyl]-3-methyl-1,2-thiazole-5-carboxylic acid Openeye Name: 4-[2-amino-1-(2-furyl)-2-thioxo-ethyl]-3-methyl-isothiazole-5-carboxylic acid CAS Name: 4-[2-amino-1-(2-furanyl)-2-sulfanylideneethyl]-3-methyl-5-isothiazolecarboxylic acid IUPAC Name: 4-[2-amino-1-(furan-2-yl)-2-sulfanylideneethyl]-3-methyl-1,2-thiazole-5-carboxylic acid Traditional Name: 4-[2-amino-1-(2-furyl)-2-thioxo-ethyl]-3-methyl-isothiazole-5-carboxylic acid Formula: C11H10N2O3S2 MolecularWeight: 282.3387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(C2=CC=CO2)C(=S)N)C(=O)O

Isomeric SMILES

CC1=NSC(=C1C(C2=CC=CO2)C(=S)N)C(=O)O

InChI

InChI=1S/C11H10N2O3S2/c1-5-7(9(11(14)15)18-13-5)8(10(12)17)6-3-2-4-16-6/h2-4,8H,1H3,(H2,12,17)(H,14,15)