3-[4,5-bis(azanyl)-6-(5-cyano-2-methyl-phenoxy)pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide

Systemtic Name: 3-[4,5-bis(azanyl)-6-(5-cyano-2-methyl-phenoxy)pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide Openeye Name: 3-[4,5-diamino-6-(5-cyano-2-methyl-phenoxy)pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide CAS Name: 3-[[4,5-diamino-6-(5-cyano-2-methylphenoxy)-2-pyrimidinyl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[4,5-diamino-6-(5-cyano-2-methylphenoxy)pyrimidin-2-yl]oxy-N,N-dimethylbenzamide Traditional Name: 3-[4,5-diamino-6-(5-cyano-2-methyl-phenoxy)pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C#N)OC2=NC(=NC(=C2N)N)OC3=CC=CC(=C3)C(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C#N)OC2=NC(=NC(=C2N)N)OC3=CC=CC(=C3)C(=O)N(C)C

InChI

InChI=1S/C21H20N6O3/c1-12-7-8-13(11-22)9-16(12)30-19-17(23)18(24)25-21(26-19)29-15-6-4-5-14(10-15)20(28)27(2)3/h4-10H,23H2,1-3H3,(H2,24,25,26)