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

Systemtic Name: 3-butyl-5-(4-fluorophenyl)-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-butyl-5-(4-fluorophenyl)-2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-butyl-5-(4-fluorophenyl)-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-butyl-5-(4-fluorophenyl)-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-butyl-5-(4-fluorophenyl)-2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]thieno[2,3-d]pyrimidin-4-one Formula: C23H26FN3O2S2 MolecularWeight: 459.599843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCCC3)SC=C2C4=CC=C(C=C4)F

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCCC3)SC=C2C4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN3O2S2/c1-3-4-13-27-22(29)19-18(16-7-9-17(24)10-8-16)14-30-20(19)25-23(27)31-15(2)21(28)26-11-5-6-12-26/h7-10,14-15H,3-6,11-13H2,1-2H3