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

Systemtic Name: N-[4-(4-azanyl-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-oxidanyl-phenyl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[4-(4-amino-7-cyclopentyl-5-pyrrolo[2,3-d]pyrimidinyl)-2-hydroxyphenyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[4-(4-amino-7-cyclopentylpyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxyphenyl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[4-(4-amino-7-cyclopentyl-pyrrolo[2,3-d]pyrimidin-5-yl)-2-hydroxy-phenyl]-4-tert-butyl-benzenesulfonamide Formula: C27H31N5O3S MolecularWeight: 505.63174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C3=CN(C4=C3C(=NC=N4)N)C5CCCC5)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C3=CN(C4=C3C(=NC=N4)N)C5CCCC5)O

InChI

InChI=1S/C27H31N5O3S/c1-27(2,3)18-9-11-20(12-10-18)36(34,35)31-22-13-8-17(14-23(22)33)21-15-32(19-6-4-5-7-19)26-24(21)25(28)29-16-30-26/h8-16,19,31,33H,4-7H2,1-3H3,(H2,28,29,30)