methyl (3S,4R)-2-methylidene-5-oxidanylidene-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4R)-2-methylidene-5-oxidanylidene-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4R)-2-methylene-5-oxo-4-(thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carboxylate CAS Name: (3S,4R)-2-methylene-5-oxo-4-(2-thiazolylamino)-4-(trifluoromethyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-2-methylidene-5-oxo-4-(1,3-thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carboxylate Traditional Name: (3S,4R)-5-keto-2-methylene-4-(thiazol-2-ylamino)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C11H10F3N3O3S MolecularWeight: 321.27561

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=C)NC(=O)C1(C(F)(F)F)NC2=NC=CS2

Isomeric SMILES

COC(=O)[C@H]1C(=C)NC(=O)[C@]1(C(F)(F)F)NC2=NC=CS2

InChI

InChI=1S/C11H10F3N3O3S/c1-5-6(7(18)20-2)10(8(19)16-5,11(12,13)14)17-9-15-3-4-21-9/h3-4,6H,1H2,2H3,(H,15,17)(H,16,19)/t6-,10-/m1/s1