N-(4-dimethylphosphorylphenyl)-2-(2-ethylmorpholin-4-yl)-9-thiophen-3-yl-purin-6-amine

Systemtic Name: N-(4-dimethylphosphorylphenyl)-2-(2-ethylmorpholin-4-yl)-9-thiophen-3-yl-purin-6-amine Openeye Name: N-(4-dimethylphosphorylphenyl)-2-(2-ethylmorpholin-4-yl)-9-(3-thienyl)purin-6-amine CAS Name: N-(4-dimethylphosphorylphenyl)-2-(2-ethyl-4-morpholinyl)-9-(3-thiophenyl)-6-purinamine IUPAC Name: N-(4-dimethylphosphorylphenyl)-2-(2-ethylmorpholin-4-yl)-9-thiophen-3-ylpurin-6-amine Traditional Name: (4-dimethylphosphorylphenyl)-[2-(2-ethylmorpholino)-9-(3-thienyl)purin-6-yl]amine Formula: C23H27N6O2PS MolecularWeight: 482.538241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CCO1)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)P(=O)(C)C)N=CN3C5=CSC=C5

Isomeric SMILES

CCC1CN(CCO1)C2=NC3=C(C(=N2)NC4=CC=C(C=C4)P(=O)(C)C)N=CN3C5=CSC=C5

InChI

InChI=1S/C23H27N6O2PS/c1-4-18-13-28(10-11-31-18)23-26-21(25-16-5-7-19(8-6-16)32(2,3)30)20-22(27-23)29(15-24-20)17-9-12-33-14-17/h5-9,12,14-15,18H,4,10-11,13H2,1-3H3,(H,25,26,27)