2-[(E)-1-(4-fluorophenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(E)-1-(4-fluorophenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(E)-2-(4-fluorophenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(E)-1-(4-fluorophenyl)-3-oxo-3-(1-pyrrolidinyl)prop-1-en-2-yl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(E)-1-(4-fluorophenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(E)-2-(4-fluorophenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H20FN3O2S MolecularWeight: 445.508603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CC=C(C=C2)F)C3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=CC=C(C=C2)F)/C3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C25H20FN3O2S/c26-18-10-8-16(9-11-18)14-19(25(31)29-12-4-5-13-29)22-27-23(30)21-20(15-32-24(21)28-22)17-6-2-1-3-7-17/h1-3,6-11,14-15H,4-5,12-13H2,(H,27,28,30)/b19-14+