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

Systemtic Name: N-[2-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-chloranyl-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-chloro-4-fluoro-benzenesulfonamide CAS Name: N-[2-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-3H-benzimidazol-5-yl]-3-chloro-4-fluorobenzenesulfonamide IUPAC Name: N-[2-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-chloro-4-fluorobenzenesulfonamide Traditional Name: N-[2-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-3H-benzimidazol-5-yl]-3-chloro-4-fluoro-benzenesulfonamide Formula: C24H21ClFN7O2S MolecularWeight: 525.985643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=NC5=C(N4)C=C(C=C5)NS(=O)(=O)C6=CC(=C(C=C6)F)Cl

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=NC5=C(N4)C=C(C=C5)NS(=O)(=O)C6=CC(=C(C=C6)F)Cl

InChI

InChI=1S/C24H21ClFN7O2S/c25-17-10-15(6-7-18(17)26)36(34,35)32-13-5-8-19-20(9-13)31-23(30-19)16-11-33(14-3-1-2-4-14)24-21(16)22(27)28-12-29-24/h5-12,14,32H,1-4H2,(H,30,31)(H2,27,28,29)