N-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinamine IUPAC Name: N-(3,4-dimethoxyphenyl)-7-(4-fluorophenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: (3,4-dimethoxyphenyl)-[7-(4-fluorophenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C26H21FN4O2 MolecularWeight: 440.468943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)F)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC3=C2C(=CN3C4=CC=C(C=C4)F)C5=CC=CC=C5)OC

InChI

InChI=1S/C26H21FN4O2/c1-32-22-13-10-19(14-23(22)33-2)30-25-24-21(17-6-4-3-5-7-17)15-31(26(24)29-16-28-25)20-11-8-18(27)9-12-20/h3-16H,1-2H3,(H,28,29,30)