5-cyclopropyl-3-phenyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-cyclopropyl-3-phenyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-cyclopropyl-3-phenyl-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-3-phenyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-3-phenyl-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-cyclopropyl-3-phenyl-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylthio]thieno[2,3-d]pyrimidin-4-one Formula: C25H21N5O2S2 MolecularWeight: 487.59654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCCCC4=NC(=NO4)C5=CC=NC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCCCC4=NC(=NO4)C5=CC=NC=C5)C6=CC=CC=C6

InChI

InChI=1S/C25H21N5O2S2/c31-24-21-19(16-8-9-16)15-34-23(21)28-25(30(24)18-5-2-1-3-6-18)33-14-4-7-20-27-22(29-32-20)17-10-12-26-13-11-17/h1-3,5-6,10-13,15-16H,4,7-9,14H2