3-(4-fluorophenyl)-5,6-dimethyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCCC3)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCCC3)C4=CC=C(C=C4)F)C

InChI

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