N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloranyl-phenyl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloranyl-phenyl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloro-phenyl]-2-fluoro-benzenesulfonamide CAS Name: N-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-2-chlorophenyl]-2-fluorobenzenesulfonamide IUPAC Name: N-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-2-chlorophenyl]-2-fluorobenzenesulfonamide Traditional Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloro-phenyl]-2-fluoro-benzenesulfonamide Formula: C23H21ClFN5O2S MolecularWeight: 485.961543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=C(C=C4)NS(=O)(=O)C5=CC=CC=C5F)Cl

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=C(C=C4)NS(=O)(=O)C5=CC=CC=C5F)Cl

InChI

InChI=1S/C23H21ClFN5O2S/c24-17-11-14(9-10-19(17)29-33(31,32)20-8-4-3-7-18(20)25)16-12-30(15-5-1-2-6-15)23-21(16)22(26)27-13-28-23/h3-4,7-13,15,29H,1-2,5-6H2,(H2,26,27,28)