2-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-dimethoxy-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-dimethoxy-phenoxy]ethanenitrile Openeye Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-phenoxy]acetonitrile CAS Name: 2-[4-[(2,4-diamino-5-pyrimidinyl)methyl]-2,6-dimethoxyphenoxy]acetonitrile IUPAC Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxyphenoxy]acetonitrile Traditional Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-phenoxy]acetonitrile Formula: C15H17N5O3 MolecularWeight: 315.32718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC#N)OC)CC2=CN=C(N=C2N)N

Isomeric SMILES

COC1=CC(=CC(=C1OCC#N)OC)CC2=CN=C(N=C2N)N

InChI

InChI=1S/C15H17N5O3/c1-21-11-6-9(5-10-8-19-15(18)20-14(10)17)7-12(22-2)13(11)23-4-3-16/h6-8H,4-5H2,1-2H3,(H4,17,18,19,20)