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

Systemtic Name: N4-cyclobutyl-N2-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-cyclobutyl-N2-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-cyclobutyl-N2-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclobutyl-2-N-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: cyclobutyl-[2-(4-phenoxyanilino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NC2=NC(=NC3=C2C=CN3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CC(C1)NC2=NC(=NC3=C2C=CN3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C22H21N5O/c1-2-7-17(8-3-1)28-18-11-9-16(10-12-18)25-22-26-20-19(13-14-23-20)21(27-22)24-15-5-4-6-15/h1-3,7-15H,4-6H2,(H3,23,24,25,26,27)