5-(4-fluorophenyl)-6-methyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-6-methyl-2-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-6-methyl-2-[(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-6-methyl-2-[[(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-6-methyl-2-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-2-[[(1R)-2-keto-1-methyl-2-pyrrolidino-ethyl]thio]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H20FN3O2S2 MolecularWeight: 417.520103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SC(C)C(=O)N3CCCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)S[C@H](C)C(=O)N3CCCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H20FN3O2S2/c1-11-15(13-5-7-14(21)8-6-13)16-17(25)22-20(23-18(16)27-11)28-12(2)19(26)24-9-3-4-10-24/h5-8,12H,3-4,9-10H2,1-2H3,(H,22,23,25)/t12-/m1/s1