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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(4-ethylphenyl)ethanone Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(4-ethylphenyl)ethanone CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-1-(4-ethylphenyl)ethanone IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(4-ethylphenyl)ethanone Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-1-(4-ethylphenyl)ethanone Formula: C14H16N4OS MolecularWeight: 288.36804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C14H16N4OS/c1-2-9-3-5-10(6-4-9)11(19)8-20-14-17-12(15)7-13(16)18-14/h3-7H,2,8H2,1H3,(H4,15,16,17,18)