5-[[(2,5-dimethoxyphenyl)methylamino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 5-[[(2,5-dimethoxyphenyl)methylamino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: 5-[[(2,5-dimethoxyphenyl)methylamino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: 5-[[(2,5-dimethoxyphenyl)methylamino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 5-[[(2,5-dimethoxyphenyl)methylamino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: (2,4-diamino-7H-pyrrolo[2,3-d]pyrimidin-5-yl)methyl-(2,5-dimethoxybenzyl)amine Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNCC2=CNC3=C2C(=NC(=N3)N)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNCC2=CNC3=C2C(=NC(=N3)N)N

InChI

InChI=1S/C16H20N6O2/c1-23-11-3-4-12(24-2)9(5-11)6-19-7-10-8-20-15-13(10)14(17)21-16(18)22-15/h3-5,8,19H,6-7H2,1-2H3,(H5,17,18,20,21,22)