1-[2-[(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanylmethyl]pyridin-3-yl]ethanone

Systemtic Name: 1-[2-[(4-azanyl-6-methylsulfanyl-pyrimidin-2-yl)sulfanylmethyl]pyridin-3-yl]ethanone Openeye Name: 1-[2-[(4-amino-6-methylsulfanyl-pyrimidin-2-yl)sulfanylmethyl]-3-pyridyl]ethanone CAS Name: 1-[2-[[[4-amino-6-(methylthio)-2-pyrimidinyl]thio]methyl]-3-pyridinyl]ethanone IUPAC Name: 1-[2-[(4-amino-6-methylsulfanylpyrimidin-2-yl)sulfanylmethyl]pyridin-3-yl]ethanone Traditional Name: 1-[2-[[[4-amino-6-(methylthio)pyrimidin-2-yl]thio]methyl]-3-pyridyl]ethanone Formula: C13H14N4OS2 MolecularWeight: 306.40646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N=CC=C1)CSC2=NC(=CC(=N2)SC)N

Isomeric SMILES

CC(=O)C1=C(N=CC=C1)CSC2=NC(=CC(=N2)SC)N

InChI

InChI=1S/C13H14N4OS2/c1-8(18)9-4-3-5-15-10(9)7-20-13-16-11(14)6-12(17-13)19-2/h3-6H,7H2,1-2H3,(H2,14,16,17)