(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid (4-keto-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C24H19N3O4S MolecularWeight: 445.49036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)OCC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)OCC3=NC4=C(C=C(S4)C5=CC=CC=C5)C(=O)N3

InChI

InChI=1S/C24H19N3O4S/c28-21-7-4-12-27(21)17-10-8-16(9-11-17)24(30)31-14-20-25-22(29)18-13-19(32-23(18)26-20)15-5-2-1-3-6-15/h1-3,5-6,8-11,13H,4,7,12,14H2,(H,25,26,29)