2-azanyl-4-[5-(bromomethyl)furan-2-yl]-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[5-(bromomethyl)furan-2-yl]-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[5-(bromomethyl)-2-furyl]-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[5-(bromomethyl)-2-furanyl]-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[5-(bromomethyl)furan-2-yl]-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[5-(bromomethyl)-2-furyl]-6-(methylthio)pyrimidine-5-carbonitrile Formula: C11H9BrN4OS MolecularWeight: 325.18436

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)C2=CC=C(O2)CBr)N

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)C2=CC=C(O2)CBr)N

InChI

InChI=1S/C11H9BrN4OS/c1-18-10-7(5-13)9(15-11(14)16-10)8-3-2-6(4-12)17-8/h2-3H,4H2,1H3,(H2,14,15,16)