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

Systemtic Name: N4-cyclobutyl-N2-[4-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-cyclobutyl-N2-[4-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-cyclobutyl-N2-[4-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-cyclobutyl-2-N-[4-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: cyclobutyl-[2-[4-(trifluoromethyl)anilino]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C17H16F3N5 MolecularWeight: 347.33765

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16F3N5/c18-17(19,20)10-4-6-12(7-5-10)23-16-24-14-13(8-9-21-14)15(25-16)22-11-2-1-3-11/h4-9,11H,1-3H2,(H3,21,22,23,24,25)