[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 3-(2-fluorophenyl)propanoate

Systemtic Name: [(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 3-(2-fluorophenyl)propanoate Openeye Name: [(3R)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl] 3-(2-fluorophenyl)propanoate CAS Name: 3-(2-fluorophenyl)propanoic acid [(3R)-3-cyano-3-(4-methyl-2-thiazolyl)-2-oxopropyl] ester IUPAC Name: [(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxopropyl] 3-(2-fluorophenyl)propanoate Traditional Name: 3-(2-fluorophenyl)propionic acid [(3R)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl] ester Formula: C17H15FN2O3S MolecularWeight: 346.376003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC(=O)CCC2=CC=CC=C2F

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)COC(=O)CCC2=CC=CC=C2F

InChI

InChI=1S/C17H15FN2O3S/c1-11-10-24-17(20-11)13(8-19)15(21)9-23-16(22)7-6-12-4-2-3-5-14(12)18/h2-5,10,13H,6-7,9H2,1H3/t13-/m1/s1