6-(2,6-dimethoxypyrimidin-4-yl)-4-phenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidine

Systemtic Name: 6-(2,6-dimethoxypyrimidin-4-yl)-4-phenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidine Openeye Name: 7-benzyl-6-(2,6-dimethoxypyrimidin-4-yl)-4-phenyl-pyrrolo[2,3-d]pyrimidine CAS Name: 6-(2,6-dimethoxy-4-pyrimidinyl)-4-phenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidine IUPAC Name: 7-benzyl-6-(2,6-dimethoxypyrimidin-4-yl)-4-phenylpyrrolo[2,3-d]pyrimidine Traditional Name: 7-benzyl-6-(2,6-dimethoxypyrimidin-4-yl)-4-phenyl-pyrrolo[2,3-d]pyrimidine Formula: C25H21N5O2 MolecularWeight: 423.46654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C2=CC3=C(N=CN=C3N2CC4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=NC(=NC(=C1)C2=CC3=C(N=CN=C3N2CC4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C25H21N5O2/c1-31-22-14-20(28-25(29-22)32-2)21-13-19-23(18-11-7-4-8-12-18)26-16-27-24(19)30(21)15-17-9-5-3-6-10-17/h3-14,16H,15H2,1-2H3