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

Systemtic Name: 3-[5-azanyl-2-(5-cyano-2-methoxy-phenoxy)-6-[(phenylmethyl)amino]pyrimidin-4-yl]oxy-N,N-dimethyl-benzamide Openeye Name: 3-[5-amino-6-(benzylamino)-2-(5-cyano-2-methoxy-phenoxy)pyrimidin-4-yl]oxy-N,N-dimethyl-benzamide CAS Name: 3-[[5-amino-2-(5-cyano-2-methoxyphenoxy)-6-[(phenylmethyl)amino]-4-pyrimidinyl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[5-amino-6-(benzylamino)-2-(5-cyano-2-methoxyphenoxy)pyrimidin-4-yl]oxy-N,N-dimethylbenzamide Traditional Name: 3-[5-amino-6-(benzylamino)-2-(5-cyano-2-methoxy-phenoxy)pyrimidin-4-yl]oxy-N,N-dimethyl-benzamide Formula: C28H26N6O4 MolecularWeight: 510.54384

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC(=NC(=C2N)NCC3=CC=CC=C3)OC4=C(C=CC(=C4)C#N)OC

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC(=NC(=C2N)NCC3=CC=CC=C3)OC4=C(C=CC(=C4)C#N)OC

InChI

InChI=1S/C28H26N6O4/c1-34(2)27(35)20-10-7-11-21(15-20)37-26-24(30)25(31-17-18-8-5-4-6-9-18)32-28(33-26)38-23-14-19(16-29)12-13-22(23)36-3/h4-15H,17,30H2,1-3H3,(H,31,32,33)