[(1R)-1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl] 3-fluoranyl-4-methyl-benzoate

Systemtic Name: [(1R)-1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl] 3-fluoranyl-4-methyl-benzoate Openeye Name: [(1R)-1-[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl] 3-fluoro-4-methyl-benzoate CAS Name: 3-fluoro-4-methylbenzoic acid [(1R)-1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl] 3-fluoro-4-methylbenzoate Traditional Name: 3-fluoro-4-methyl-benzoic acid [(1R)-1-[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl] ester Formula: C20H15FN2O3S2 MolecularWeight: 414.473103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O[C@H](C)C2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2)F

InChI

InChI=1S/C20H15FN2O3S2/c1-10-5-6-12(8-14(10)21)20(25)26-11(2)17-22-18(24)16-13(9-28-19(16)23-17)15-4-3-7-27-15/h3-9,11H,1-2H3,(H,22,23,24)/t11-/m1/s1