2-azanyl-4-(4-iodanylpyrazol-1-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-(4-iodanylpyrazol-1-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(4-iodopyrazol-1-yl)-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(4-iodo-1-pyrazolyl)-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-(4-iodopyrazol-1-yl)-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(4-iodopyrazol-1-yl)-6-(methylthio)pyrimidine-5-carbonitrile Formula: C9H7IN6S MolecularWeight: 358.16155

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)N2C=C(C=N2)I)N

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)N2C=C(C=N2)I)N

InChI

InChI=1S/C9H7IN6S/c1-17-8-6(2-11)7(14-9(12)15-8)16-4-5(10)3-13-16/h3-4H,1H3,(H2,12,14,15)