2-[(4-bromanyl-5-pyrimidin-2-ylsulfanyl-furan-2-yl)methylidene]propanedinitrile

Systemtic Name: 2-[(4-bromanyl-5-pyrimidin-2-ylsulfanyl-furan-2-yl)methylidene]propanedinitrile Openeye Name: 2-[(4-bromo-5-pyrimidin-2-ylsulfanyl-2-furyl)methylene]propanedinitrile CAS Name: 2-[[4-bromo-5-(2-pyrimidinylthio)-2-furanyl]methylidene]propanedinitrile IUPAC Name: 2-[(4-bromo-5-pyrimidin-2-ylsulfanylfuran-2-yl)methylidene]propanedinitrile Traditional Name: 2-[[4-bromo-5-(2-pyrimidylthio)-2-furyl]methylene]malononitrile Formula: C12H5BrN4OS MolecularWeight: 333.1633

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC2=C(C=C(O2)C=C(C#N)C#N)Br

Isomeric SMILES

C1=CN=C(N=C1)SC2=C(C=C(O2)C=C(C#N)C#N)Br

InChI

InChI=1S/C12H5BrN4OS/c13-10-5-9(4-8(6-14)7-15)18-11(10)19-12-16-2-1-3-17-12/h1-5H