N2-(3-chloranyl-4-methoxy-phenyl)-N4-[2,2,2-tris(fluoranyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N2-(3-chloranyl-4-methoxy-phenyl)-N4-[2,2,2-tris(fluoranyl)ethyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N2-(3-chloro-4-methoxy-phenyl)-N4-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N2-(3-chloro-4-methoxyphenyl)-N4-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-chloro-4-methoxyphenyl)-4-N-(2,2,2-trifluoroethyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: [2-(3-chloro-4-methoxy-anilino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-(2,2,2-trifluoroethyl)amine Formula: C15H13ClF3N5O MolecularWeight: 371.74483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC3=C(C=CN3)C(=N2)NCC(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC3=C(C=CN3)C(=N2)NCC(F)(F)F)Cl

InChI

InChI=1S/C15H13ClF3N5O/c1-25-11-3-2-8(6-10(11)16)22-14-23-12-9(4-5-20-12)13(24-14)21-7-15(17,18)19/h2-6H,7H2,1H3,(H3,20,21,22,23,24)