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

Systemtic Name: N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloranyl-phenyl]-2-cyano-benzenesulfonamide Openeye Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloro-phenyl]-2-cyano-benzenesulfonamide CAS Name: N-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-2-chlorophenyl]-2-cyanobenzenesulfonamide IUPAC Name: N-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-2-chlorophenyl]-2-cyanobenzenesulfonamide Traditional Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-chloro-phenyl]-2-cyano-benzenesulfonamide Formula: C24H21ClN6O2S MolecularWeight: 492.98054

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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=C5C#N)Cl

Isomeric SMILES

C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC(=C(C=C4)NS(=O)(=O)C5=CC=CC=C5C#N)Cl

InChI

InChI=1S/C24H21ClN6O2S/c25-19-11-15(9-10-20(19)30-34(32,33)21-8-4-1-5-16(21)12-26)18-13-31(17-6-2-3-7-17)24-22(18)23(27)28-14-29-24/h1,4-5,8-11,13-14,17,30H,2-3,6-7H2,(H2,27,28,29)