5-(4-fluorophenyl)-4-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-fluorophenyl)-4-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidine Openeye Name: 5-(4-fluorophenyl)-4-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]thieno[2,3-d]pyrimidine CAS Name: 5-(4-fluorophenyl)-4-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-fluorophenyl)-4-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidine Traditional Name: 5-(4-fluorophenyl)-4-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]thieno[2,3-d]pyrimidine Formula: C21H18FN3O3S3 MolecularWeight: 475.579323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)CSC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(O2)CSC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C21H18FN3O3S3/c22-15-5-3-14(4-6-15)17-12-30-21-19(17)20(23-13-24-21)29-11-16-7-8-18(28-16)31(26,27)25-9-1-2-10-25/h3-8,12-13H,1-2,9-11H2