(2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-[2,2,2-tris(fluoranyl)ethyl]butanamide

Systemtic Name: (2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-[2,2,2-tris(fluoranyl)ethyl]butanamide Openeye Name: (2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2,2,2-trifluoroethyl)butanamide CAS Name: (2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-7-pyrrolo[2,3-d]pyrimidinyl]-N-(2,2,2-trifluoroethyl)butanamide IUPAC Name: (2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2,2,2-trifluoroethyl)butanamide Traditional Name: (2R)-3-methyl-2-[2-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-N-(2,2,2-trifluoroethyl)butyramide Formula: C19H18F3N7O MolecularWeight: 417.38773

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(F)(F)F)N1C=CC2=CN=C(N=C21)C3=CNC4=NC=NC=C34

Isomeric SMILES

CC(C)[C@H](C(=O)NCC(F)(F)F)N1C=CC2=CN=C(N=C21)C3=CNC4=NC=NC=C34

InChI

InChI=1S/C19H18F3N7O/c1-10(2)14(18(30)26-8-19(20,21)22)29-4-3-11-5-24-16(28-17(11)29)13-7-25-15-12(13)6-23-9-27-15/h3-7,9-10,14H,8H2,1-2H3,(H,26,30)(H,23,25,27)/t14-/m1/s1