(5-cyano-2-fluoranyl-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: (5-cyano-2-fluoranyl-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: (5-cyano-2-fluoro-phenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-acetamido-4,5-dimethyl-3-thiophenecarboxylic acid (5-cyano-2-fluorophenyl)methyl ester IUPAC Name: (5-cyano-2-fluorophenyl)methyl 2-acetamido-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-acetamido-4,5-dimethyl-thiophene-3-carboxylic acid (5-cyano-2-fluoro-benzyl) ester Formula: C17H15FN2O3S MolecularWeight: 346.376003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=C(C=CC(=C2)C#N)F)NC(=O)C)C

InChI

InChI=1S/C17H15FN2O3S/c1-9-10(2)24-16(20-11(3)21)15(9)17(22)23-8-13-6-12(7-19)4-5-14(13)18/h4-6H,8H2,1-3H3,(H,20,21)