6-cyclohexyl-1-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one

Systemtic Name: 6-cyclohexyl-1-[2-(5-fluoranyl-1H-indol-3-yl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Openeye Name: 6-cyclohexyl-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one CAS Name: 6-cyclohexyl-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one IUPAC Name: 6-cyclohexyl-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Traditional Name: 6-cyclohexyl-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-thioxo-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one Formula: C22H26FN5OS MolecularWeight: 427.538143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CCC4=CNC5=C4C=C(C=C5)F

Isomeric SMILES

C1CCC(CC1)N2CC3=C(NC2)N(C(=S)NC3=O)CCC4=CNC5=C4C=C(C=C5)F

InChI

InChI=1S/C22H26FN5OS/c23-15-6-7-19-17(10-15)14(11-24-19)8-9-28-20-18(21(29)26-22(28)30)12-27(13-25-20)16-4-2-1-3-5-16/h6-7,10-11,16,24-25H,1-5,8-9,12-13H2,(H,26,29,30)