2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylthio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C14H9N3O3S2 MolecularWeight: 331.36956

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NO2)CSC3=NC4=C(C=CS4)C(=O)N3

Isomeric SMILES

C1=COC(=C1)C2=CC(=NO2)CSC3=NC4=C(C=CS4)C(=O)N3

InChI

InChI=1S/C14H9N3O3S2/c18-12-9-3-5-21-13(9)16-14(15-12)22-7-8-6-11(20-17-8)10-2-1-4-19-10/h1-6H,7H2,(H,15,16,18)