2-(cyanomethylsulfanyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-olate

Systemtic Name: 2-(cyanomethylsulfanyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-olate Openeye Name: 2-(cyanomethylsulfanyl)-6-phenyl-thieno[2,3-d]pyrimidin-4-olate CAS Name: 2-(cyanomethylthio)-6-phenyl-4-thieno[2,3-d]pyrimidinolate IUPAC Name: 2-(cyanomethylsulfanyl)-6-phenylthieno[2,3-d]pyrimidin-4-olate Traditional Name: 2-(cyanomethylthio)-6-phenyl-thieno[2,3-d]pyrimidin-4-olate Formula: C14H8N3OS2- MolecularWeight: 298.36282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(N=C(N=C3S2)SCC#N)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(N=C(N=C3S2)SCC#N)[O-]

InChI

InChI=1S/C14H9N3OS2/c15-6-7-19-14-16-12(18)10-8-11(20-13(10)17-14)9-4-2-1-3-5-9/h1-5,8H,7H2,(H,16,17,18)/p-1