[(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 5-(2-chlorophenyl)furan-2-carboxylate

Systemtic Name: [(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 5-(2-chlorophenyl)furan-2-carboxylate Openeye Name: [(3R)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl] 5-(2-chlorophenyl)furan-2-carboxylate CAS Name: 5-(2-chlorophenyl)-2-furancarboxylic 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] 5-(2-chlorophenyl)furan-2-carboxylate Traditional Name: 5-(2-chlorophenyl)furan-2-carboxylic acid [(3R)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl] ester Formula: C19H13ClN2O4S MolecularWeight: 400.83552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)COC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl

Isomeric SMILES

CC1=CSC(=N1)[C@H](C#N)C(=O)COC(=O)C2=CC=C(O2)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H13ClN2O4S/c1-11-10-27-18(22-11)13(8-21)15(23)9-25-19(24)17-7-6-16(26-17)12-4-2-3-5-14(12)20/h2-7,10,13H,9H2,1H3/t13-/m1/s1