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

Systemtic Name: 1-[2-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethoxy]phenyl]ethanone Openeye Name: 1-[2-[2-(4,6-diaminopyrimidin-2-yl)sulfanylethoxy]phenyl]ethanone CAS Name: 1-[2-[2-[(4,6-diamino-2-pyrimidinyl)thio]ethoxy]phenyl]ethanone IUPAC Name: 1-[2-[2-(4,6-diaminopyrimidin-2-yl)sulfanylethoxy]phenyl]ethanone Traditional Name: 1-[2-[2-[(4,6-diaminopyrimidin-2-yl)thio]ethoxy]phenyl]ethanone Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1OCCSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(=O)C1=CC=CC=C1OCCSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C14H16N4O2S/c1-9(19)10-4-2-3-5-11(10)20-6-7-21-14-17-12(15)8-13(16)18-14/h2-5,8H,6-7H2,1H3,(H4,15,16,17,18)