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

Systemtic Name: [(3R)-3-cyano-3-(4-methyl-1,3-thiazol-2-yl)-2-oxidanylidene-propyl] 3,3-diphenylpropanoate Openeye Name: [(3R)-3-cyano-3-(4-methylthiazol-2-yl)-2-oxo-propyl] 3,3-diphenylpropanoate CAS Name: 3,3-diphenylpropanoic 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] 3,3-diphenylpropanoate Traditional Name: 3,3-diphenylpropionic acid [(3R)-3-cyano-2-keto-3-(4-methylthiazol-2-yl)propyl] ester Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O3S/c1-16-15-29-23(25-16)20(13-24)21(26)14-28-22(27)12-19(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,15,19-20H,12,14H2,1H3/t20-/m1/s1