1-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-diethoxy-phenyl]-2-methylsulfonyl-ethanone

Systemtic Name: 1-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-diethoxy-phenyl]-2-methylsulfonyl-ethanone Openeye Name: 1-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxy-phenyl]-2-methylsulfonyl-ethanone CAS Name: 1-[4-[(2,4-diamino-5-pyrimidinyl)methyl]-2,6-diethoxyphenyl]-2-methylsulfonylethanone IUPAC Name: 1-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxyphenyl]-2-methylsulfonylethanone Traditional Name: 1-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxy-phenyl]-2-mesyl-ethanone Formula: C18H24N4O5S MolecularWeight: 408.47196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)CS(=O)(=O)C)OCC)CC2=CN=C(N=C2N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)CS(=O)(=O)C)OCC)CC2=CN=C(N=C2N)N

InChI

InChI=1S/C18H24N4O5S/c1-4-26-14-7-11(6-12-9-21-18(20)22-17(12)19)8-15(27-5-2)16(14)13(23)10-28(3,24)25/h7-9H,4-6,10H2,1-3H3,(H4,19,20,21,22)