ethyl 4-[4-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]phenoxy]butanoate

Systemtic Name: ethyl 4-[4-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]phenoxy]butanoate Openeye Name: ethyl 4-[4-[(4-benzyloxy-6-phenyl-pyrimidin-2-yl)amino]phenoxy]butanoate CAS Name: 4-[4-[(4-phenyl-6-phenylmethoxy-2-pyrimidinyl)amino]phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-phenyl-6-phenylmethoxypyrimidin-2-yl)amino]phenoxy]butanoate Traditional Name: 4-[4-[(4-benzoxy-6-phenyl-pyrimidin-2-yl)amino]phenoxy]butyric acid ethyl ester Formula: C29H29N3O4 MolecularWeight: 483.55826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=C(C=C1)NC2=NC(=CC(=N2)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCCOC1=CC=C(C=C1)NC2=NC(=CC(=N2)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O4/c1-2-34-28(33)14-9-19-35-25-17-15-24(16-18-25)30-29-31-26(23-12-7-4-8-13-23)20-27(32-29)36-21-22-10-5-3-6-11-22/h3-8,10-13,15-18,20H,2,9,14,19,21H2,1H3,(H,30,31,32)