2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C20H15FN2O3S3 MolecularWeight: 446.538103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=C4C(=CC(=C3)F)COCO4)SC=C2C5=CC=CS5

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=C4C(=CC(=C3)F)COCO4)SC=C2C5=CC=CS5

InChI

InChI=1S/C20H15FN2O3S3/c1-23-19(24)16-14(15-3-2-4-27-15)9-28-18(16)22-20(23)29-8-12-6-13(21)5-11-7-25-10-26-17(11)12/h2-6,9H,7-8,10H2,1H3