3-ethyl-5-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-5-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-5-phenyl-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-5-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-5-phenyl-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-5-phenyl-2-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C21H16N4O2S3 MolecularWeight: 452.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC3=NC(=NO3)C4=CC=CS4)SC=C2C5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC3=NC(=NO3)C4=CC=CS4)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C21H16N4O2S3/c1-2-25-20(26)17-14(13-7-4-3-5-8-13)11-29-19(17)23-21(25)30-12-16-22-18(24-27-16)15-9-6-10-28-15/h3-11H,2,12H2,1H3