(2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate

Systemtic Name: (2-methoxy-2-oxidanylidene-1-phenyl-ethyl) 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Openeye Name: (2-methoxy-2-oxo-1-phenyl-ethyl) 3-methyl-5-(methylamino)isothiazole-4-carboxylate CAS Name: 3-methyl-5-(methylamino)-4-isothiazolecarboxylic acid (2-methoxy-2-oxo-1-phenylethyl) ester IUPAC Name: (2-methoxy-2-oxo-1-phenylethyl) 3-methyl-5-(methylamino)-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-(methylamino)isothiazole-4-carboxylic acid (2-keto-2-methoxy-1-phenyl-ethyl) ester Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)OC)NC

Isomeric SMILES

CC1=NSC(=C1C(=O)OC(C2=CC=CC=C2)C(=O)OC)NC

InChI

InChI=1S/C15H16N2O4S/c1-9-11(13(16-2)22-17-9)14(18)21-12(15(19)20-3)10-7-5-4-6-8-10/h4-8,12,16H,1-3H3