N4-cyclobutyl-N2-(3,5-dimethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N4-cyclobutyl-N2-(3,5-dimethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-cyclobutyl-N2-(3,5-dimethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-cyclobutyl-N2-(3,5-dimethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclobutyl-2-N-(3,5-dimethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: cyclobutyl-[2-(3,5-dimethoxyanilino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC3=C(C=CN3)C(=N2)NC4CCC4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC3=C(C=CN3)C(=N2)NC4CCC4)OC

InChI

InChI=1S/C18H21N5O2/c1-24-13-8-12(9-14(10-13)25-2)21-18-22-16-15(6-7-19-16)17(23-18)20-11-4-3-5-11/h6-11H,3-5H2,1-2H3,(H3,19,20,21,22,23)