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

Systemtic Name: 5-cyclopropyl-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-cyclopropyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-cyclopropyl-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H19FN2O3S2 MolecularWeight: 466.547663

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=C5C(=CC(=C4)F)COCO5)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC4=C5C(=CC(=C4)F)COCO5)C6=CC=CC=C6

InChI

InChI=1S/C24H19FN2O3S2/c25-17-8-15-10-29-13-30-21(15)16(9-17)11-32-24-26-22-20(19(12-31-22)14-6-7-14)23(28)27(24)18-4-2-1-3-5-18/h1-5,8-9,12,14H,6-7,10-11,13H2