2-azanyl-4-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-(3,3-dimethyl-2-oxidanylidene-butyl)sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-(3,3-dimethyl-2-oxo-butyl)sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[(3,3-dimethyl-2-oxobutyl)thio]-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-(3,3-dimethyl-2-oxobutyl)sulfanyl-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[(2-keto-3,3-dimethyl-butyl)thio]-6-(methylthio)pyrimidine-5-carbonitrile Formula: C12H16N4OS2 MolecularWeight: 296.41164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC(=NC(=C1C#N)SC)N

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC(=NC(=C1C#N)SC)N

InChI

InChI=1S/C12H16N4OS2/c1-12(2,3)8(17)6-19-10-7(5-13)9(18-4)15-11(14)16-10/h6H2,1-4H3,(H2,14,15,16)