N2-quinoxalin-6-yl-N4-[2,2,2-tris(fluoranyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N2-quinoxalin-6-yl-N4-[2,2,2-tris(fluoranyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N2-quinoxalin-6-yl-N4-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N2-(6-quinoxalinyl)-N4-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 2-N-quinoxalin-6-yl-4-N-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: quinoxalin-6-yl-[4-(2,2,2-trifluoroethylamino)-7H-pyrrolo[2,3-d]pyrimidin-2-yl]amine Formula: C16H12F3N7 MolecularWeight: 359.30859

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=CN=C2C=C1NC3=NC4=C(C=CN4)C(=N3)NCC(F)(F)F

Isomeric SMILES

C1=CC2=NC=CN=C2C=C1NC3=NC4=C(C=CN4)C(=N3)NCC(F)(F)F

InChI

InChI=1S/C16H12F3N7/c17-16(18,19)8-23-14-10-3-4-22-13(10)25-15(26-14)24-9-1-2-11-12(7-9)21-6-5-20-11/h1-7H,8H2,(H3,22,23,24,25,26)