5-[[6,7-dimethoxy-2-[(4-phenylphenyl)methyl]-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[6,7-dimethoxy-2-[(4-phenylphenyl)methyl]-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[6,7-dimethoxy-2-[(4-phenylphenyl)methyl]benzofuran-4-yl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[6,7-dimethoxy-2-[(4-phenylphenyl)methyl]-4-benzofuranyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[6,7-dimethoxy-2-[(4-phenylphenyl)methyl]-1-benzofuran-4-yl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[[6,7-dimethoxy-2-(4-phenylbenzyl)benzofuran-4-yl]methyl]pyrimidin-4-yl]amine Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(O2)CC3=CC=C(C=C3)C4=CC=CC=C4)C(=C1)CC5=CN=C(N=C5N)N)OC

Isomeric SMILES

COC1=C(C2=C(C=C(O2)CC3=CC=C(C=C3)C4=CC=CC=C4)C(=C1)CC5=CN=C(N=C5N)N)OC

InChI

InChI=1S/C28H26N4O3/c1-33-24-14-20(13-21-16-31-28(30)32-27(21)29)23-15-22(35-25(23)26(24)34-2)12-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,14-16H,12-13H2,1-2H3,(H4,29,30,31,32)