2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(p-tolyl)ethanone CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-1-(4-methylphenyl)ethanone IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(4-methylphenyl)ethanone Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-1-(p-tolyl)ethanone Formula: C13H14N4OS MolecularWeight: 274.34146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C13H14N4OS/c1-8-2-4-9(5-3-8)10(18)7-19-13-16-11(14)6-12(15)17-13/h2-6H,7H2,1H3,(H4,14,15,16,17)