2-azanyl-4-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[2-(3,5-dimethylpyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[2-(3,5-dimethylpyrazol-1-yl)-2-oxo-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[[2-(3,5-dimethyl-1-pyrazolyl)-2-oxoethyl]thio]-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[[2-(3,5-dimethylpyrazol-1-yl)-2-keto-ethyl]thio]-6-(methylthio)pyrimidine-5-carbonitrile Formula: C13H14N6OS2 MolecularWeight: 334.41986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=NC(=NC(=C2C#N)SC)N)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=NC(=NC(=C2C#N)SC)N)C

InChI

InChI=1S/C13H14N6OS2/c1-7-4-8(2)19(18-7)10(20)6-22-12-9(5-14)11(21-3)16-13(15)17-12/h4H,6H2,1-3H3,(H2,15,16,17)