2-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-2-(4-methylpyridin-2-yl)ethanenitrile

Systemtic Name: 2-(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-2-(4-methylpyridin-2-yl)ethanenitrile Openeye Name: 2-(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanyl-2-(4-methyl-2-pyridyl)acetonitrile CAS Name: 2-[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]-2-(4-methyl-2-pyridinyl)acetonitrile IUPAC Name: 2-(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanyl-2-(4-methylpyridin-2-yl)acetonitrile Traditional Name: 2-[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]-2-(4-methyl-2-pyridyl)acetonitrile Formula: C13H13N5S2 MolecularWeight: 303.40582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(C#N)SC2=NC(=CC(=N2)SC)N

Isomeric SMILES

CC1=CC(=NC=C1)C(C#N)SC2=NC(=CC(=N2)SC)N

InChI

InChI=1S/C13H13N5S2/c1-8-3-4-16-9(5-8)10(7-14)20-13-17-11(15)6-12(18-13)19-2/h3-6,10H,1-2H3,(H2,15,17,18)