1-[4-[[4,6-bis(azanyl)-2-methylsulfanyl-pyrimidin-5-yl]diazenyl]phenyl]ethanone

Systemtic Name: 1-[4-[[4,6-bis(azanyl)-2-methylsulfanyl-pyrimidin-5-yl]diazenyl]phenyl]ethanone Openeye Name: 1-[4-(4,6-diamino-2-methylsulfanyl-pyrimidin-5-yl)azophenyl]ethanone CAS Name: 1-[4-[[4,6-diamino-2-(methylthio)-5-pyrimidinyl]azo]phenyl]ethanone IUPAC Name: 1-[4-[(4,6-diamino-2-methylsulfanylpyrimidin-5-yl)diazenyl]phenyl]ethanone Traditional Name: 1-[4-[4,6-diamino-2-(methylthio)pyrimidin-5-yl]azophenyl]ethanone Formula: C13H14N6OS MolecularWeight: 302.35486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N=NC2=C(N=C(N=C2N)SC)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N=NC2=C(N=C(N=C2N)SC)N

InChI

InChI=1S/C13H14N6OS/c1-7(20)8-3-5-9(6-4-8)18-19-10-11(14)16-13(21-2)17-12(10)15/h3-6H,1-2H3,(H4,14,15,16,17)